N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide

C24H28N2O2 — CID 56922153

IUPACN-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide
SMILESO=C1CCCN1Cc1ccc(CNC(=O)C2(c3ccccc3)CCCC2)cc1
InChIInChI=1S/C24H28N2O2/c27-22-9-6-16-26(22)18-20-12-10-19(11-13-20)17-25-23(28)24(14-4-5-15-24)21-7-2-1-3-8-21/h1-3,7-8,10-13H,4-6,9,14-18H2,(H,25,28)
InChIKeyVHUSRWDYPIAUCL-UHFFFAOYSA-N
MW376.50 g/mol
LogP3.94
Rot. Bonds6

About N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide

N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide (PubChem CID 56922153) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide
PubChem CID56922153
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC NameN-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide
SMILESO=C1CCCN1Cc1ccc(CNC(=O)C2(c3ccccc3)CCCC2)cc1
InChIInChI=1S/C24H28N2O2/c27-22-9-6-16-26(22)18-20-12-10-19(11-13-20)17-25-23(28)24(14-4-5-15-24)21-7-2-1-3-8-21/h1-3,7-8,10-13H,4-6,9,14-18H2,(H,25,28)
InChIKeyVHUSRWDYPIAUCL-UHFFFAOYSA-N
XLogP3.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[(1-phenylcyclohexanecarbonyl)amino]methyl]benzoic acid
CID 134561755
1-(3-chlorophenyl)-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]cyclopentane-1-carboxamide
CID 39410534
N-[(4-chlorophenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 35571496
N-[(4-morpholin-4-ylphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 56922098
N-[[4-(azepan-1-ylmethyl)phenyl]methyl]-4-phenyloxane-4-carboxamide
CID 47085199
N-[(4-fluorophenyl)methyl]-1-phenylcyclopropane-1-carboxamide
CID 2540117
4-(aminomethyl)-N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]benzamide
CID 119285773
1-(3-fluorophenyl)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]cyclobutane-1-carboxamide
CID 30875236
4-benzyl-N'-methyl-N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]piperazine-1-carboximidamide;hydroiodide
CID 110959528
2-methyl-1-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]guanidine;hydroiodide
CID 110917873
1-amino-N-[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119285129
1-[(3-methylphenyl)methyl]-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]urea
CID 38387385

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide (CID 56922153) is N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide is O=C1CCCN1Cc1ccc(CNC(=O)C2(c3ccccc3)CCCC2)cc1.
What is the InChIKey of N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide?
The InChIKey is VHUSRWDYPIAUCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c27-22-9-6-16-26(22)18-20-12-10-19(11-13-20)17-25-23(28)24(14-4-5-15-24)21-7-2-1-3-8-21/h1-3,7-8,10-13H,4-6,9,14-18H2,(H,25,28).
What are the key properties of N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide?
N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide has a molecular weight of 376.50 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 56922153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).