N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide

C13H16N2O — CID 51714392

IUPACN-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide
SMILESNc1ccccc1NC(=O)C[C@H]1C=CCC1
InChIInChI=1S/C13H16N2O/c14-11-7-3-4-8-12(11)15-13(16)9-10-5-1-2-6-10/h1,3-5,7-8,10H,2,6,9,14H2,(H,15,16)/t10-/m0/s1
InChIKeyIQVUGXWFXKDEOI-JTQLQIEISA-N
MW216.28 g/mol
LogP2.56
Rot. Bonds3

About N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide

N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide (PubChem CID 51714392) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide
PubChem CID51714392
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC NameN-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide
SMILESNc1ccccc1NC(=O)C[C@H]1C=CCC1
InChIInChI=1S/C13H16N2O/c14-11-7-3-4-8-12(11)15-13(16)9-10-5-1-2-6-10/h1,3-5,7-8,10H,2,6,9,14H2,(H,15,16)/t10-/m0/s1
InChIKeyIQVUGXWFXKDEOI-JTQLQIEISA-N
XLogP2.56
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminophenyl)-4-[[(2-cyclopent-2-en-1-ylacetyl)amino]methyl]benzamide
CID 10337895
2-[(1S)-cyclopent-2-en-1-yl]-N-(2,3-difluorophenyl)acetamide
CID 94813097
2-[(1R)-cyclopent-2-en-1-yl]-N-(2,3-difluorophenyl)acetamide
CID 94813098
2-[(1S)-cyclopent-2-en-1-yl]-N-(2-methylsulfonylphenyl)acetamide
CID 51929140
2-cyclopent-2-en-1-yl-N-[2-(methylaminomethyl)phenyl]acetamide
CID 43600979
2-cyclopent-2-en-1-yl-N-[2-(difluoromethylsulfanyl)phenyl]acetamide
CID 78807815
2-cyclopent-2-en-1-yl-N-[2-(2,3-dihydroindol-1-yl)phenyl]acetamide
CID 43066797
N-[2-[(2-cyclopent-2-en-1-ylacetyl)amino]phenyl]-3,4,4-trimethylpentanamide
CID 86901395
N-(2-bromo-3-chlorophenyl)-2-cyclopent-2-en-1-ylacetamide
CID 103479839
N-[2-[[acetyl(methyl)amino]methyl]phenyl]-2-cyclopent-2-en-1-ylacetamide
CID 46403346
2-cyclopent-2-en-1-yl-N-(2-methyl-3-sulfamoylphenyl)acetamide
CID 47337033
N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride
CID 119259903

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide?
The IUPAC name of N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide (CID 51714392) is N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide.
What is the SMILES notation for N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide?
The canonical SMILES for N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide is Nc1ccccc1NC(=O)C[C@H]1C=CCC1.
What is the InChIKey of N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide?
The InChIKey is IQVUGXWFXKDEOI-JTQLQIEISA-N. The full InChI is InChI=1S/C13H16N2O/c14-11-7-3-4-8-12(11)15-13(16)9-10-5-1-2-6-10/h1,3-5,7-8,10H,2,6,9,14H2,(H,15,16)/t10-/m0/s1.
What are the key properties of N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide?
N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide has a molecular weight of 216.28 g/mol, XLogP of 2.56, 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-[(1S)-cyclopent-2-en-1-yl]acetamide is sourced from PubChem (CID 51714392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).