N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride

C13H19ClN2O — CID 119259903

IUPACN-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride
SMILESCl.Nc1ccccc1NC(=O)CC1CCCC1
InChIInChI=1S/C13H18N2O.ClH/c14-11-7-3-4-8-12(11)15-13(16)9-10-5-1-2-6-10;/h3-4,7-8,10H,1-2,5-6,9,14H2,(H,15,16);1H
InChIKeyNSNLVKDFQDOHDY-UHFFFAOYSA-N
MW254.76 g/mol
LogP3.21
Rot. Bonds3

About N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride

N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride (PubChem CID 119259903) has the molecular formula C13H19ClN2O and a molecular weight of 254.76 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride
PubChem CID119259903
Molecular FormulaC13H19ClN2O
Molecular Weight254.76 g/mol
Exact Mass254.12
IUPAC NameN-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride
SMILESCl.Nc1ccccc1NC(=O)CC1CCCC1
InChIInChI=1S/C13H18N2O.ClH/c14-11-7-3-4-8-12(11)15-13(16)9-10-5-1-2-6-10;/h3-4,7-8,10H,1-2,5-6,9,14H2,(H,15,16);1H
InChIKeyNSNLVKDFQDOHDY-UHFFFAOYSA-N
XLogP3.21
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 53.21
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

N-(2-aminophenyl)-2-(3-methylcyclohexyl)acetamide
CID 119422441
N-(3-amino-2-chlorophenyl)-2-cyclohexylacetamide
CID 114270030
2-[3-[2-(2-aminoanilino)-2-oxoethyl]cyclohexyl]-N-(4-hydroxyphenyl)acetamide
CID 71483891
N-(2-amino-5-chlorophenyl)-2-cycloheptylacetamide
CID 114457006
N-(2-bromophenyl)-2-cyclopentylacetamide
CID 24707693
N-(2-aminophenyl)-2-cyclopentylsulfanylacetamide
CID 63114529
N-(2-amino-4-bromophenyl)-2-cyclohexylacetamide
CID 43130499
N-(2-aminophenyl)-3-cyclohexylbutanamide;hydrochloride
CID 119422685
2-[(2-cycloheptylacetyl)amino]benzoic acid
CID 114457097
N-[2-(aminomethyl)phenyl]-2-cyclobutylacetamide
CID 103164982
2-cyclobutyl-N-(2-iodophenyl)acetamide
CID 103706273
2-cyano-N-[2-[(2-cyclopentylacetyl)amino]phenyl]acetamide
CID 108923007

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride?
The IUPAC name of N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride (CID 119259903) is N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride.
What is the SMILES notation for N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride?
The canonical SMILES for N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride is Cl.Nc1ccccc1NC(=O)CC1CCCC1.
What is the InChIKey of N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride?
The InChIKey is NSNLVKDFQDOHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O.ClH/c14-11-7-3-4-8-12(11)15-13(16)9-10-5-1-2-6-10;/h3-4,7-8,10H,1-2,5-6,9,14H2,(H,15,16);1H.
What are the key properties of N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride?
N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride has a molecular weight of 254.76 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride is sourced from PubChem (CID 119259903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).