2-cyclobutyl-N-(4-formylphenyl)acetamide

C13H15NO2 — CID 106912258

IUPAC2-cyclobutyl-N-(4-formylphenyl)acetamide
SMILESO=Cc1ccc(NC(=O)CC2CCC2)cc1
InChIInChI=1S/C13H15NO2/c15-9-11-4-6-12(7-5-11)14-13(16)8-10-2-1-3-10/h4-7,9-10H,1-3,8H2,(H,14,16)
InChIKeyINRJYNVYGUPMOI-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.63
Rot. Bonds4

About 2-cyclobutyl-N-(4-formylphenyl)acetamide

2-cyclobutyl-N-(4-formylphenyl)acetamide (PubChem CID 106912258) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 2-cyclobutyl-N-(4-formylphenyl)acetamide.

Molecular Properties

Compound Name2-cyclobutyl-N-(4-formylphenyl)acetamide
PubChem CID106912258
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name2-cyclobutyl-N-(4-formylphenyl)acetamide
SMILESO=Cc1ccc(NC(=O)CC2CCC2)cc1
InChIInChI=1S/C13H15NO2/c15-9-11-4-6-12(7-5-11)14-13(16)8-10-2-1-3-10/h4-7,9-10H,1-3,8H2,(H,14,16)
InChIKeyINRJYNVYGUPMOI-UHFFFAOYSA-N
XLogP2.63
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-[4-[(2-cyclobutylacetyl)amino]phenyl]prop-2-enoic acid
CID 103925644
2-cyclopentyl-N-(4-iodophenyl)acetamide
CID 2677478
2-cyclohexyl-N-(4-iodophenyl)acetamide
CID 807079
2-[3-[2-(4-methylanilino)-2-oxoethyl]cyclohexyl]-N-(4-methylphenyl)acetamide
CID 58862999
2-cyclopentyl-N-pyridin-4-ylacetamide
CID 11839759
2-cyclopentyl-N-(4-propan-2-ylphenyl)acetamide
CID 11839703
2-cyclopentyl-N-[4-(dimethylamino)phenyl]acetamide
CID 47097970
N-(3-amino-4-fluorophenyl)-2-cyclobutylacetamide
CID 103805248
2-cyclobutyl-N-[4-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenyl]acetamide
CID 103163862
2-cyclopropyl-N-(4-sulfanylphenyl)acetamide
CID 68600520
2-cyclopropyl-N-phenylacetamide
CID 60753326
N-(4-cyanophenyl)-2-cycloheptylacetamide
CID 115679897

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-(4-formylphenyl)acetamide?
The IUPAC name of 2-cyclobutyl-N-(4-formylphenyl)acetamide (CID 106912258) is 2-cyclobutyl-N-(4-formylphenyl)acetamide.
What is the SMILES notation for 2-cyclobutyl-N-(4-formylphenyl)acetamide?
The canonical SMILES for 2-cyclobutyl-N-(4-formylphenyl)acetamide is O=Cc1ccc(NC(=O)CC2CCC2)cc1.
What is the InChIKey of 2-cyclobutyl-N-(4-formylphenyl)acetamide?
The InChIKey is INRJYNVYGUPMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c15-9-11-4-6-12(7-5-11)14-13(16)8-10-2-1-3-10/h4-7,9-10H,1-3,8H2,(H,14,16).
What are the key properties of 2-cyclobutyl-N-(4-formylphenyl)acetamide?
2-cyclobutyl-N-(4-formylphenyl)acetamide has a molecular weight of 217.27 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-(4-formylphenyl)acetamide is sourced from PubChem (CID 106912258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).