2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide

C13H25NO — CID 21366377

IUPAC2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide
SMILESCCCC(CC1CC1C)C(=O)NC(C)C
InChIInChI=1S/C13H25NO/c1-5-6-11(8-12-7-10(12)4)13(15)14-9(2)3/h9-12H,5-8H2,1-4H3,(H,14,15)
InChIKeyJUTKSHHGXRRRPP-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.97
Rot. Bonds6

About 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide

2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide (PubChem CID 21366377) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide.

Molecular Properties

Compound Name2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide
PubChem CID21366377
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide
SMILESCCCC(CC1CC1C)C(=O)NC(C)C
InChIInChI=1S/C13H25NO/c1-5-6-11(8-12-7-10(12)4)13(15)14-9(2)3/h9-12H,5-8H2,1-4H3,(H,14,15)
InChIKeyJUTKSHHGXRRRPP-UHFFFAOYSA-N
XLogP2.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide 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 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide?
The IUPAC name of 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide (CID 21366377) is 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide.
What is the SMILES notation for 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide?
The canonical SMILES for 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide is CCCC(CC1CC1C)C(=O)NC(C)C.
What is the InChIKey of 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide?
The InChIKey is JUTKSHHGXRRRPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-5-6-11(8-12-7-10(12)4)13(15)14-9(2)3/h9-12H,5-8H2,1-4H3,(H,14,15).
What are the key properties of 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide?
2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide has a molecular weight of 211.35 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylcyclopropyl)methyl]-N-propan-2-ylpentanamide is sourced from PubChem (CID 21366377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).