3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride

C20H24Cl2N2O — CID 120610238

IUPAC3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride
SMILESCl.Nc1ccccc1CCC(=O)NC1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C20H23ClN2O.ClH/c21-17-10-8-16(9-11-17)20(13-3-4-14-20)23-19(24)12-7-15-5-1-2-6-18(15)22;/h1-2,5-6,8-11H,3-4,7,12-14,22H2,(H,23,24);1H
InChIKeyUWGMTWYYZJUDLW-UHFFFAOYSA-N
MW379.33 g/mol
LogP4.86
Rot. Bonds5

About 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride

3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride (PubChem CID 120610238) has the molecular formula C20H24Cl2N2O and a molecular weight of 379.33 g/mol. Its IUPAC name is 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride.

Molecular Properties

Compound Name3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride
PubChem CID120610238
Molecular FormulaC20H24Cl2N2O
Molecular Weight379.33 g/mol
Exact Mass378.13
IUPAC Name3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride
SMILESCl.Nc1ccccc1CCC(=O)NC1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C20H23ClN2O.ClH/c21-17-10-8-16(9-11-17)20(13-3-4-14-20)23-19(24)12-7-15-5-1-2-6-18(15)22;/h1-2,5-6,8-11H,3-4,7,12-14,22H2,(H,23,24);1H
InChIKeyUWGMTWYYZJUDLW-UHFFFAOYSA-N
XLogP4.86
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.33
LogP ≤ 54.86
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

4-amino-N-[1-(4-chlorophenyl)cyclopentyl]butanamide
CID 119313669
3-(2-aminophenyl)-N-(4-chlorophenyl)propanamide
CID 28713936
3-(2-aminophenyl)-N-(3-methyloxolan-3-yl)propanamide;hydrochloride
CID 120613594
methyl 1-[3-(2-aminophenyl)propanoylamino]cycloheptane-1-carboxylate
CID 120608576
N-[1-(4-chlorophenyl)cyclopropyl]butanamide
CID 113091058
N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide
CID 119764374
4-oxo-4-[(1-phenylcyclopentyl)amino]butanoic acid
CID 110442749
N-[1-(4-chlorophenyl)cyclopropyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111464638
3-(2-aminophenyl)-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]propanamide;hydrochloride
CID 120611838
N-[1-(4-chlorophenyl)cyclobutyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
CID 47071392
7-amino-N-[1-(3-chlorophenyl)cyclopentyl]heptanamide;hydrochloride
CID 119815402
4-oxo-4-[(1-phenylcyclohexyl)amino]butanoic acid
CID 110465792

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride?
The IUPAC name of 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride (CID 120610238) is 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride.
What is the SMILES notation for 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride?
The canonical SMILES for 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride is Cl.Nc1ccccc1CCC(=O)NC1(c2ccc(Cl)cc2)CCCC1.
What is the InChIKey of 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride?
The InChIKey is UWGMTWYYZJUDLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O.ClH/c21-17-10-8-16(9-11-17)20(13-3-4-14-20)23-19(24)12-7-15-5-1-2-6-18(15)22;/h1-2,5-6,8-11H,3-4,7,12-14,22H2,(H,23,24);1H.
What are the key properties of 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride?
3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride has a molecular weight of 379.33 g/mol, XLogP of 4.86, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride is sourced from PubChem (CID 120610238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).