N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide

C20H23NO2 — CID 4644139

IUPACN-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
SMILESCOc1ccccc1CNC(=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C20H23NO2/c1-23-18-12-6-5-9-16(18)15-21-19(22)20(13-7-8-14-20)17-10-3-2-4-11-17/h2-6,9-12H,7-8,13-15H2,1H3,(H,21,22)
InChIKeyWYVIOYFWINLANX-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.82
Rot. Bonds5

About N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide

N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide (PubChem CID 4644139) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
PubChem CID4644139
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC NameN-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
SMILESCOc1ccccc1CNC(=O)C1(c2ccccc2)CCCC1
InChIInChI=1S/C20H23NO2/c1-23-18-12-6-5-9-16(18)15-21-19(22)20(13-7-8-14-20)17-10-3-2-4-11-17/h2-6,9-12H,7-8,13-15H2,1H3,(H,21,22)
InChIKeyWYVIOYFWINLANX-UHFFFAOYSA-N
XLogP3.82
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(methanesulfonamido)phenyl]-N-[(2-methoxyphenyl)methyl]cyclohexane-1-carboxamide
CID 53110497
N-[[2-(methoxymethyl)phenyl]methyl]-1-phenylcyclobutane-1-carboxamide
CID 33068095
N-[2-(2-methoxyphenoxy)ethyl]-1-phenylcyclopentane-1-carboxamide
CID 100551991
1-(2-fluorobenzoyl)-N-[(2-methoxyphenyl)methyl]-4-phenylpiperidine-4-carboxamide
CID 23600304
N-[(3-ethoxy-4-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 100600748
1-phenyl-N-[[2-(trifluoromethyl)phenyl]methyl]cyclopentane-1-carboxamide
CID 3527303
N-ethyl-1-phenylcyclopentane-1-carboxamide
CID 778764
1-N-[(2-methoxyphenyl)methyl]-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108976196
N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]-1-phenylcyclobutane-1-carboxamide
CID 55979347
N-[(2,4-dimethoxyphenyl)methyl]-1-(3-fluorophenyl)cyclopentane-1-carboxamide
CID 55595601
1-(cyclopentylidenemethyl)-3-[(2-methoxyphenyl)methyl]urea
CID 108913694
2-[[1-(2-methoxyphenyl)cyclopentanecarbonyl]amino]acetic acid
CID 110466240

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide (CID 4644139) is N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide is COc1ccccc1CNC(=O)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide?
The InChIKey is WYVIOYFWINLANX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-23-18-12-6-5-9-16(18)15-21-19(22)20(13-7-8-14-20)17-10-3-2-4-11-17/h2-6,9-12H,7-8,13-15H2,1H3,(H,21,22).
What are the key properties of N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide?
N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 4644139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).