3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide

C19H22N2O — CID 119770621

IUPAC3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide
SMILESCc1cccc(C2(NC(=O)c3cccc(N)c3)CCCC2)c1
InChIInChI=1S/C19H22N2O/c1-14-6-4-8-16(12-14)19(10-2-3-11-19)21-18(22)15-7-5-9-17(20)13-15/h4-9,12-13H,2-3,10-11,20H2,1H3,(H,21,22)
InChIKeyQAOUQRXYKOWEHW-UHFFFAOYSA-N
MW294.40 g/mol
LogP3.78
Rot. Bonds3

About 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide

3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide (PubChem CID 119770621) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide.

Molecular Properties

Compound Name3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide
PubChem CID119770621
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC Name3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide
SMILESCc1cccc(C2(NC(=O)c3cccc(N)c3)CCCC2)c1
InChIInChI=1S/C19H22N2O/c1-14-6-4-8-16(12-14)19(10-2-3-11-19)21-18(22)15-7-5-9-17(20)13-15/h4-9,12-13H,2-3,10-11,20H2,1H3,(H,21,22)
InChIKeyQAOUQRXYKOWEHW-UHFFFAOYSA-N
XLogP3.78
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-amino-N-[1-(3-methylphenyl)cyclopentyl]propanamide
CID 119316008
N-[1-(4-fluorophenyl)cyclobutyl]-3-methylbenzamide
CID 110441487
4-[acetyl(methyl)amino]-N-[1-(3-methylphenyl)cyclobutyl]benzamide
CID 138002353
N-[1-(4-chlorophenyl)cyclopropyl]-3-methylbenzamide
CID 110441479
3-amino-N-[1-(hydroxymethyl)cyclopentyl]benzamide
CID 55081511
4-[[1-(3-methylphenyl)cyclopentyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120673434
4-amino-3-methoxy-N-[1-(3-methylphenyl)cyclopentyl]butanamide
CID 120591466
1-[1-(3-aminophenyl)cyclopropyl]-3-propan-2-ylurea
CID 110490986
tert-butyl N-[1-(3-aminophenyl)cyclobutyl]carbamate
CID 22981091
N-[1-(3-methylphenyl)cyclopentyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119770626
3-amino-N-[(1-methylcyclohexyl)methyl]benzamide
CID 103813013
5-amino-2-methyl-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]benzamide
CID 120636519

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide?
The IUPAC name of 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide (CID 119770621) is 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide.
What is the SMILES notation for 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide?
The canonical SMILES for 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide is Cc1cccc(C2(NC(=O)c3cccc(N)c3)CCCC2)c1.
What is the InChIKey of 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide?
The InChIKey is QAOUQRXYKOWEHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O/c1-14-6-4-8-16(12-14)19(10-2-3-11-19)21-18(22)15-7-5-9-17(20)13-15/h4-9,12-13H,2-3,10-11,20H2,1H3,(H,21,22).
What are the key properties of 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide?
3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide has a molecular weight of 294.40 g/mol, XLogP of 3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(3-methylphenyl)cyclopentyl]benzamide is sourced from PubChem (CID 119770621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).