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Search term: HVBKXYHKSMCJOF-UHFFFAOYAG
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Inherent Properties, Identifiers and References
ChemSpider ID: 107582
Empirical Formula: C20H30ClN3O2
Molecular Weight: 379.9241
Nominal Mass: 379 Da
Average Mass: 379.9241 Da
Monoisotopic Mass: 379.202655 Da
Systematic Name: 3-(2-diethylaminoethyl)-1-phenyl-1,3-diazaspiro[4.5]decane-2,4-di​one hydrochloride
SMILES: Cl.O=C2N(C(=O)N(c1ccccc1)C23CCCCC3)CCN(CC)CC
InChI: InChI=1/C20H29N3O2.ClH/c1-3-21(4-2)15-16-22-18(24)20(13-9-6-10-14​-20)23(19(22)25)17-11-7-5-8-12-17;/h5,7-8,11-12H,3-4,6,9-10,13-16​H2,1-2H3;1H
InChIKey: HVBKXYHKSMCJOF-UHFFFAOYAG
Std. InChI: InChI=1S/C20H29N3O2.ClH/c1-3-21(4-2)15-16-22-18(24)20(13-9-6-10-1​4-20)23(19(22)25)17-11-7-5-8-12-17;/h5,7-8,11-12H,3-4,6,9-10,13-1​6H2,1-2H3;1H
Std. InChIKey: HVBKXYHKSMCJOF-UHFFFAOYSA-N
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Names and Synonyms

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

1,3-Diaza​spiro(4.5​)decane-2​,4-dione,​ 3-(2-(di​ethylamin​o)ethyl)-​1-phenyl-​, hydroch​loride

3'-(2-Die​thylamino​ethyl)-1'​-phenylcy​clohexane​spiro-5'-​hydantoin​ hydrochl​oride

976-90-9 [RN]

ACD/LogP: 3.35 # of Rule of 5 Violations: 0
ACD/LogD (pH 5.5): 0.28 ACD/LogD (pH 7.4): 1
ACD/BCF (pH 5.5): 1 ACD/BCF (pH 7.4): 1
ACD/KOC (pH 5.5): 1.33 ACD/KOC (pH 7.4): 6.98
#H bond acceptors: 5 #H bond donors: 0
#Freely Rotating Bonds: 6 Polar Surface Area: 43.86 Å2
Index of Refraction: Molar Refractivity: cm3
Molar Volume: cm3 Polarizability: 10-24cm3
Surface Tension: dyne/cm Density: g/cm3
Flash Point: 180.3 °C Enthalpy of Vaporization: 71.57 kJ/mol
Boiling Point: 455.8 °C at 760 mmHg Vapour Pressure: 1.7E-08 mmHg at 25°C