N-(1-oxopentan-2-yl)cyclopropanecarboxamide

C9H15NO2 — CID 175249523

IUPACN-(1-oxopentan-2-yl)cyclopropanecarboxamide
SMILESCCCC(C=O)NC(=O)C1CC1
InChIInChI=1S/C9H15NO2/c1-2-3-8(6-11)10-9(12)7-4-5-7/h6-8H,2-5H2,1H3,(H,10,12)
InChIKeyUPRAAMZJTUQSBI-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.88
Rot. Bonds5

About N-(1-oxopentan-2-yl)cyclopropanecarboxamide

N-(1-oxopentan-2-yl)cyclopropanecarboxamide (PubChem CID 175249523) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is N-(1-oxopentan-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(1-oxopentan-2-yl)cyclopropanecarboxamide
PubChem CID175249523
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC NameN-(1-oxopentan-2-yl)cyclopropanecarboxamide
SMILESCCCC(C=O)NC(=O)C1CC1
InChIInChI=1S/C9H15NO2/c1-2-3-8(6-11)10-9(12)7-4-5-7/h6-8H,2-5H2,1H3,(H,10,12)
InChIKeyUPRAAMZJTUQSBI-UHFFFAOYSA-N
XLogP0.88
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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

Computed Properties (RDKit)

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

Analyze N-(1-oxopentan-2-yl)cyclopropanecarboxamide 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-pentan-2-ylcyclopropanecarboxamide
CID 43889322
N-heptan-4-yl-4-methylcyclohexane-1-carboxamide
CID 143046395
N-pentan-2-ylcyclohexanecarboxamide
CID 19916603
N-(1-oxo-3-phenylpropan-2-yl)cyclopropanecarboxamide
CID 142081270
N-(4-hydroxybutan-2-yl)cyclopropanecarboxamide
CID 81042795
N-hex-1-yn-3-ylcyclobutanecarboxamide
CID 103528729
N-heptan-2-yl-4-methylcyclohexane-1-carboxamide
CID 143290950
ethyl 2-(cyclopropanecarbonylamino)propanoate
CID 58636709
2-amino-4-methyl-N-(1-oxopentan-2-yl)pentanamide
CID 19826425
N-[(3S)-hexan-3-yl]oxane-4-carboxamide
CID 170970278
N-[1-oxo-1-(propylamino)propan-2-yl]cyclopropanecarboxamide
CID 60659669
trans-(1R,4R)-N-[(2R)-1-oxo-3-phenylpropan-2-yl]-4-propan-2-ylcycloheptane-1-carboxamide
CID 143582761

Frequently Asked Questions

What is the IUPAC name of N-(1-oxopentan-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(1-oxopentan-2-yl)cyclopropanecarboxamide (CID 175249523) is N-(1-oxopentan-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(1-oxopentan-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(1-oxopentan-2-yl)cyclopropanecarboxamide is CCCC(C=O)NC(=O)C1CC1.
What is the InChIKey of N-(1-oxopentan-2-yl)cyclopropanecarboxamide?
The InChIKey is UPRAAMZJTUQSBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-2-3-8(6-11)10-9(12)7-4-5-7/h6-8H,2-5H2,1H3,(H,10,12).
What are the key properties of N-(1-oxopentan-2-yl)cyclopropanecarboxamide?
N-(1-oxopentan-2-yl)cyclopropanecarboxamide has a molecular weight of 169.22 g/mol, XLogP of 0.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-oxopentan-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 175249523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).