3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide

C24H32N2O2 — CID 56583821

IUPAC3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide
SMILESO=C(CCN(CCCO)C(c1ccccc1)c1ccccc1)NC1CCCC1
InChIInChI=1S/C24H32N2O2/c27-19-9-17-26(18-16-23(28)25-22-14-7-8-15-22)24(20-10-3-1-4-11-20)21-12-5-2-6-13-21/h1-6,10-13,22,24,27H,7-9,14-19H2,(H,25,28)
InChIKeyQQILQQSKMOYQLW-UHFFFAOYSA-N
MW380.53 g/mol
LogP3.91
Rot. Bonds10

About 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide

3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide (PubChem CID 56583821) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide
PubChem CID56583821
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC Name3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide
SMILESO=C(CCN(CCCO)C(c1ccccc1)c1ccccc1)NC1CCCC1
InChIInChI=1S/C24H32N2O2/c27-19-9-17-26(18-16-23(28)25-22-14-7-8-15-22)24(20-10-3-1-4-11-20)21-12-5-2-6-13-21/h1-6,10-13,22,24,27H,7-9,14-19H2,(H,25,28)
InChIKeyQQILQQSKMOYQLW-UHFFFAOYSA-N
XLogP3.91
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[benzhydryl(3-hydroxypropyl)amino]-N-(2-methylcyclohexyl)acetamide
CID 56513235
N-cyclododecyl-N'-(1-phenylethyl)butanediamide
CID 4025526
3-(N-acetylanilino)-N-cyclohexylpropanamide
CID 113123341
3-[[2-(cyclohexylamino)-2-oxoethyl]-(3-hydroxypropyl)amino]propanoic acid
CID 82326965
(3S)-N-cyclopentyl-3-phenylbutanamide
CID 697485
3-[benzhydryl(butyl)amino]propan-1-ol
CID 56583759
3-[butyl(2-hydroxyethyl)amino]-N-cyclohexylpropanamide
CID 62016596
N-cyclohexyl-5-hydroxypentanamide
CID 11367641
N-cyclooctyl-5-oxo-5-phenylpentanamide
CID 20969095
N-cyclopentyl-N'-(4-hydroxy-4-phenylbutan-2-yl)butanediamide
CID 109478424
1-cyclopentyl-3-(2,2-diphenylethyl)urea
CID 38287341
N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876

Frequently Asked Questions

What is the IUPAC name of 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide?
The IUPAC name of 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide (CID 56583821) is 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide.
What is the SMILES notation for 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide?
The canonical SMILES for 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide is O=C(CCN(CCCO)C(c1ccccc1)c1ccccc1)NC1CCCC1.
What is the InChIKey of 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide?
The InChIKey is QQILQQSKMOYQLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c27-19-9-17-26(18-16-23(28)25-22-14-7-8-15-22)24(20-10-3-1-4-11-20)21-12-5-2-6-13-21/h1-6,10-13,22,24,27H,7-9,14-19H2,(H,25,28).
What are the key properties of 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide?
3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide has a molecular weight of 380.53 g/mol, XLogP of 3.91, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[benzhydryl(3-hydroxypropyl)amino]-N-cyclopentylpropanamide is sourced from PubChem (CID 56583821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).