1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide

C9H15NO2 — CID 58257022

IUPAC1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide
SMILESCC(=O)CNC(=O)C1(C)CCC1
InChIInChI=1S/C9H15NO2/c1-7(11)6-10-8(12)9(2)4-3-5-9/h3-6H2,1-2H3,(H,10,12)
InChIKeyKAXQSAMBJCVPKC-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.88
Rot. Bonds3

About 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide

1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide (PubChem CID 58257022) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide
PubChem CID58257022
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide
SMILESCC(=O)CNC(=O)C1(C)CCC1
InChIInChI=1S/C9H15NO2/c1-7(11)6-10-8(12)9(2)4-3-5-9/h3-6H2,1-2H3,(H,10,12)
InChIKeyKAXQSAMBJCVPKC-UHFFFAOYSA-N
XLogP0.88
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-oxopropyl)cyclobutanecarboxamide
CID 23273479
N-[(2,2-dimethyl-3-oxocyclobutyl)methyl]acetamide
CID 13059208
N-ethyl-3,3-dimethyl-2-oxobutanamide
CID 13355141
N,3,3-trimethyl-2-oxopentanamide
CID 21353749
2,2-dimethyl-N-(2-oxopropyl)butanamide
CID 22972298
2-ethyl-2-methyl-N-(2-oxopropyl)butanamide
CID 57783617
3-methyl-N-(5-methyl-2-oxohexyl)butanamide
CID 58223927
N-ethyl-4,4-dimethyl-2-oxopentanamide
CID 58286909
2,2-dimethyl-N-(2,2,5,5-tetramethyl-4-oxohexan-3-yl)propanamide
CID 58363540
N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclobutanecarboxamide
CID 58363631
N-(5-deuterio-2-oxopentyl)-2-ethyl-2-methylbutanamide
CID 59105857
5,5-dimethyl-4-oxo-N-(2-oxopropyl)hexanamide
CID 59407277

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide?
The IUPAC name of 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide (CID 58257022) is 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide.
What is the SMILES notation for 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide?
The canonical SMILES for 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide is CC(=O)CNC(=O)C1(C)CCC1.
What is the InChIKey of 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide?
The InChIKey is KAXQSAMBJCVPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-7(11)6-10-8(12)9(2)4-3-5-9/h3-6H2,1-2H3,(H,10,12).
What are the key properties of 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide?
1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide has a molecular weight of 169.22 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-oxopropyl)cyclobutane-1-carboxamide is sourced from PubChem (CID 58257022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).