2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide

C10H18FNO2 — CID 159259614

IUPAC2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide
SMILESCC(=O)CC(C)(F)C(=O)N(C)C(C)C
InChIInChI=1S/C10H18FNO2/c1-7(2)12(5)9(14)10(4,11)6-8(3)13/h7H,6H2,1-5H3
InChIKeyYLRQWWXEIXGZQB-UHFFFAOYSA-N
MW203.26 g/mol
LogP1.56
Rot. Bonds4

About 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide

2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide (PubChem CID 159259614) has the molecular formula C10H18FNO2 and a molecular weight of 203.26 g/mol. Its IUPAC name is 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide.

Molecular Properties

Compound Name2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide
PubChem CID159259614
Molecular FormulaC10H18FNO2
Molecular Weight203.26 g/mol
Exact Mass203.13
IUPAC Name2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide
SMILESCC(=O)CC(C)(F)C(=O)N(C)C(C)C
InChIInChI=1S/C10H18FNO2/c1-7(2)12(5)9(14)10(4,11)6-8(3)13/h7H,6H2,1-5H3
InChIKeyYLRQWWXEIXGZQB-UHFFFAOYSA-N
XLogP1.56
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.26
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-N,2-dimethyl-4-oxo-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-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide?
The IUPAC name of 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide (CID 159259614) is 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide.
What is the SMILES notation for 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide?
The canonical SMILES for 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide is CC(=O)CC(C)(F)C(=O)N(C)C(C)C.
What is the InChIKey of 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide?
The InChIKey is YLRQWWXEIXGZQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FNO2/c1-7(2)12(5)9(14)10(4,11)6-8(3)13/h7H,6H2,1-5H3.
What are the key properties of 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide?
2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide has a molecular weight of 203.26 g/mol, XLogP of 1.56, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,2-dimethyl-4-oxo-N-propan-2-ylpentanamide is sourced from PubChem (CID 159259614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).