N-cyclopropylbutanamide

C7H13NO — CID 3339101

IUPACN-cyclopropylbutanamide
SMILESCCCC(=O)NC1CC1
InChIInChI=1S/C7H13NO/c1-2-3-7(9)8-6-4-5-6/h6H,2-5H2,1H3,(H,8,9)
InChIKeyRIORBKZTLFEWDG-UHFFFAOYSA-N
MW127.19 g/mol
LogP1.07
Rot. Bonds3

About N-cyclopropylbutanamide

N-cyclopropylbutanamide (PubChem CID 3339101) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is N-cyclopropylbutanamide.

Molecular Properties

Compound NameN-cyclopropylbutanamide
PubChem CID3339101
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC NameN-cyclopropylbutanamide
SMILESCCCC(=O)NC1CC1
InChIInChI=1S/C7H13NO/c1-2-3-7(9)8-6-4-5-6/h6H,2-5H2,1H3,(H,8,9)
InChIKeyRIORBKZTLFEWDG-UHFFFAOYSA-N
XLogP1.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-cyclopropylbutanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropylbutanamide?
The IUPAC name of N-cyclopropylbutanamide (CID 3339101) is N-cyclopropylbutanamide.
What is the SMILES notation for N-cyclopropylbutanamide?
The canonical SMILES for N-cyclopropylbutanamide is CCCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropylbutanamide?
The InChIKey is RIORBKZTLFEWDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-2-3-7(9)8-6-4-5-6/h6H,2-5H2,1H3,(H,8,9).
What are the key properties of N-cyclopropylbutanamide?
N-cyclopropylbutanamide has a molecular weight of 127.19 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropylbutanamide is sourced from PubChem (CID 3339101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).