2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride

C14H21ClN2O — CID 119736524

IUPAC2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride
SMILESCC1(NC(=O)Cc2ccc(N)cc2)CCCC1.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-14(8-2-3-9-14)16-13(17)10-11-4-6-12(15)7-5-11;/h4-7H,2-3,8-10,15H2,1H3,(H,16,17);1H
InChIKeyUWHAJWNNLJULAV-UHFFFAOYSA-N
MW268.79 g/mol
LogP2.68
Rot. Bonds3

About 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride

2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride (PubChem CID 119736524) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride
PubChem CID119736524
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC Name2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride
SMILESCC1(NC(=O)Cc2ccc(N)cc2)CCCC1.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-14(8-2-3-9-14)16-13(17)10-11-4-6-12(15)7-5-11;/h4-7H,2-3,8-10,15H2,1H3,(H,16,17);1H
InChIKeyUWHAJWNNLJULAV-UHFFFAOYSA-N
XLogP2.68
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-(4-aminophenyl)-N-(1-methylcyclobutyl)propanamide
CID 113485218
2-(3-aminophenyl)-N-(1-methylcyclopentyl)acetamide
CID 55083856
2-(4-aminophenyl)-N-[(1-methylcyclopentyl)methyl]acetamide;hydrochloride
CID 119780541
2-(4-aminophenyl)-N-[(1-ethylcyclopentyl)methyl]acetamide;hydrochloride
CID 119812218
2-[1-[[2-(4-aminophenyl)acetyl]amino]cyclopentyl]acetic acid
CID 64700742
2-(4-aminophenyl)-N-[(1-ethylcyclobutyl)methyl]acetamide;hydrochloride
CID 119782137
2-(5-amino-2-oxo-1-pyridinyl)-N-(1-methylcyclohexyl)acetamide
CID 62814628
2-(4-aminophenyl)acetyl chloride;ethane
CID 143474750
4-amino-2-chloro-N-(1-methylcyclohexyl)benzamide;hydrochloride
CID 119736471
4-[2-[(1-methylcyclopentyl)amino]ethyl]aniline
CID 64687654
2-(4-aminophenyl)-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]acetamide;hydrochloride
CID 119747038
2-(4-aminophenyl)-1-(3,3-dimethylpiperidin-1-yl)ethanone;hydrochloride
CID 119734675

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride?
The IUPAC name of 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride (CID 119736524) is 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride?
The canonical SMILES for 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride is CC1(NC(=O)Cc2ccc(N)cc2)CCCC1.Cl.
What is the InChIKey of 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride?
The InChIKey is UWHAJWNNLJULAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O.ClH/c1-14(8-2-3-9-14)16-13(17)10-11-4-6-12(15)7-5-11;/h4-7H,2-3,8-10,15H2,1H3,(H,16,17);1H.
What are the key properties of 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride?
2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride has a molecular weight of 268.79 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-(1-methylcyclopentyl)acetamide;hydrochloride is sourced from PubChem (CID 119736524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).