2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide

C14H20N2O — CID 43370694

IUPAC2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide
SMILESNc1ccc(CC(=O)NCC2CCCC2)cc1
InChIInChI=1S/C14H20N2O/c15-13-7-5-11(6-8-13)9-14(17)16-10-12-3-1-2-4-12/h5-8,12H,1-4,9-10,15H2,(H,16,17)
InChIKeyJVGGVYPQTPSAFO-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.12
Rot. Bonds4

About 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide

2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide (PubChem CID 43370694) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide
PubChem CID43370694
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide
SMILESNc1ccc(CC(=O)NCC2CCCC2)cc1
InChIInChI=1S/C14H20N2O/c15-13-7-5-11(6-8-13)9-14(17)16-10-12-3-1-2-4-12/h5-8,12H,1-4,9-10,15H2,(H,16,17)
InChIKeyJVGGVYPQTPSAFO-UHFFFAOYSA-N
XLogP2.12
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.12
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-(cyclopentylmethyl)propanamide
CID 43371351
N-(cyclohexylmethyl)-2-(4-fluorophenyl)acetamide
CID 83278373
N-(cycloheptylmethyl)-2-phenylacetamide
CID 54313529
2-(4-aminophenyl)-N-(3-cyclopentylpropyl)acetamide
CID 103630550
N-(cyclobutylmethyl)-2-(4-fluorophenyl)acetamide
CID 94168873
3-(4-aminophenyl)-N-(cyclopropylmethyl)propanamide
CID 43309173
2-(4-cyanophenyl)-N-(cyclobutylmethyl)acetamide
CID 62403309
N-(cyclohexylmethyl)-2-(4-pyrrol-1-ylphenyl)acetamide
CID 43071662
1-(4-aminophenyl)-3-cyclopentylpropan-2-one
CID 116549551
2-(4-aminophenyl)-N-[[1-(3-methylbutyl)piperidin-4-yl]methyl]acetamide
CID 119898863
2-(4-aminophenyl)-N-[(2-methylcyclopropyl)methyl]acetamide
CID 115597585
cyclohexylmethyl 2-(4-aminophenyl)acetate
CID 61321508

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide?
The IUPAC name of 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide (CID 43370694) is 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide is Nc1ccc(CC(=O)NCC2CCCC2)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide?
The InChIKey is JVGGVYPQTPSAFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c15-13-7-5-11(6-8-13)9-14(17)16-10-12-3-1-2-4-12/h5-8,12H,1-4,9-10,15H2,(H,16,17).
What are the key properties of 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide?
2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide has a molecular weight of 232.33 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-(cyclopentylmethyl)acetamide is sourced from PubChem (CID 43370694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).