2-(4-aminophenyl)-N-cyclobutylacetamide

C12H16N2O — CID 62416481

IUPAC2-(4-aminophenyl)-N-cyclobutylacetamide
SMILESNc1ccc(CC(=O)NC2CCC2)cc1
InChIInChI=1S/C12H16N2O/c13-10-6-4-9(5-7-10)8-12(15)14-11-2-1-3-11/h4-7,11H,1-3,8,13H2,(H,14,15)
InChIKeyVXFZWWONYSLUNS-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.48
Rot. Bonds3

About 2-(4-aminophenyl)-N-cyclobutylacetamide

2-(4-aminophenyl)-N-cyclobutylacetamide (PubChem CID 62416481) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-cyclobutylacetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-cyclobutylacetamide
PubChem CID62416481
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-(4-aminophenyl)-N-cyclobutylacetamide
SMILESNc1ccc(CC(=O)NC2CCC2)cc1
InChIInChI=1S/C12H16N2O/c13-10-6-4-9(5-7-10)8-12(15)14-11-2-1-3-11/h4-7,11H,1-3,8,13H2,(H,14,15)
InChIKeyVXFZWWONYSLUNS-UHFFFAOYSA-N
XLogP1.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.48
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-[[2-(4-aminophenyl)acetyl]amino]-N-cyclohexylpropanamide;hydrochloride
CID 119741910
N-cyclobutyl-2-(4-sulfanylphenyl)acetamide
CID 107028316
2-[4-(aminomethyl)phenyl]-N-cyclooctylacetamide
CID 63588883
N-cyclohexyl-2-(4-formylphenyl)acetamide
CID 142533026
2-[(4-aminophenyl)methylsulfonyl]-N-cyclohexylacetamide
CID 94804331
ethyl 4-[[2-(4-aminophenyl)acetyl]amino]cyclohexane-1-carboxylate
CID 119738178
2-(4-aminophenyl)-N-(1-ethylsulfonylpiperidin-4-yl)acetamide;hydrochloride
CID 119702884
2-(4-aminophenyl)-N-(4-butylcyclohexyl)acetamide;hydrochloride
CID 119750326
N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876
2-(3-aminophenyl)-N-cyclohexylacetamide
CID 28689689
2-(4-aminophenyl)sulfanyl-N-cyclopentylacetamide
CID 19317767
2-(3-aminophenyl)-N-cycloheptylacetamide
CID 28712073

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-cyclobutylacetamide?
The IUPAC name of 2-(4-aminophenyl)-N-cyclobutylacetamide (CID 62416481) is 2-(4-aminophenyl)-N-cyclobutylacetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-cyclobutylacetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-cyclobutylacetamide is Nc1ccc(CC(=O)NC2CCC2)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-cyclobutylacetamide?
The InChIKey is VXFZWWONYSLUNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c13-10-6-4-9(5-7-10)8-12(15)14-11-2-1-3-11/h4-7,11H,1-3,8,13H2,(H,14,15).
What are the key properties of 2-(4-aminophenyl)-N-cyclobutylacetamide?
2-(4-aminophenyl)-N-cyclobutylacetamide has a molecular weight of 204.27 g/mol, XLogP of 1.48, 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-cyclobutylacetamide is sourced from PubChem (CID 62416481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).