N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide

C21H25NO2 — CID 110016113

IUPACN-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide
SMILESO=C(NCC(Cc1ccccc1)c1ccccc1)C1CCCC1O
InChIInChI=1S/C21H25NO2/c23-20-13-7-12-19(20)21(24)22-15-18(17-10-5-2-6-11-17)14-16-8-3-1-4-9-16/h1-6,8-11,18-20,23H,7,12-15H2,(H,22,24)
InChIKeyPKXOOWZWPOXOBC-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.29
Rot. Bonds6

About N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide

N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide (PubChem CID 110016113) has the molecular formula C21H25NO2 and a molecular weight of 323.44 g/mol. Its IUPAC name is N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide
PubChem CID110016113
Molecular FormulaC21H25NO2
Molecular Weight323.44 g/mol
Exact Mass323.19
IUPAC NameN-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide
SMILESO=C(NCC(Cc1ccccc1)c1ccccc1)C1CCCC1O
InChIInChI=1S/C21H25NO2/c23-20-13-7-12-19(20)21(24)22-15-18(17-10-5-2-6-11-17)14-16-8-3-1-4-9-16/h1-6,8-11,18-20,23H,7,12-15H2,(H,22,24)
InChIKeyPKXOOWZWPOXOBC-UHFFFAOYSA-N
XLogP3.29
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-diphenylpropyl)piperidine-2-carboxamide
CID 119335224
1-cyclopropyl-3-(2,3-diphenylpropyl)urea
CID 110307425
N-(2,3-diphenylpropyl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119803955
cis-(1S,2R)-2-[[(2S)-2-phenylbutyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 96564436
2-hydroxy-N-(2-methyl-3-phenylmethoxypropyl)cyclopentane-1-carboxamide
CID 110015433
(2S,5R)-5-(aminomethyl)-N-(2,3-diphenylpropyl)oxolane-2-carboxamide;hydrochloride
CID 120794963
1-amino-N-(2,3-diphenylpropyl)cyclopentane-1-carboxamide
CID 119335236
2-hydroxy-N-(1-phenylbutan-2-yl)cyclopentane-1-carboxamide
CID 110015652
N-(2,3-diphenylpropyl)-2-pyrrolidin-2-ylacetamide
CID 119803974
cis-(1R,2S)-2-hydroxy-N-(2-phenylethyl)cyclohexane-1-carboxamide
CID 13313986
N-[(2S)-2-phenylbutyl]cyclobutanecarboxamide
CID 39952483
(3R)-N-[(2S)-2,3-diphenylpropyl]morpholine-3-carboxamide
CID 124699410

Frequently Asked Questions

What is the IUPAC name of N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide (CID 110016113) is N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide is O=C(NCC(Cc1ccccc1)c1ccccc1)C1CCCC1O.
What is the InChIKey of N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide?
The InChIKey is PKXOOWZWPOXOBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO2/c23-20-13-7-12-19(20)21(24)22-15-18(17-10-5-2-6-11-17)14-16-8-3-1-4-9-16/h1-6,8-11,18-20,23H,7,12-15H2,(H,22,24).
What are the key properties of N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide?
N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide has a molecular weight of 323.44 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-diphenylpropyl)-2-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110016113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).