2-fluoro-N-methylpentanamide

C6H12FNO — CID 90374763

IUPAC2-fluoro-N-methylpentanamide
SMILESCCCC(F)C(=O)NC
InChIInChI=1S/C6H12FNO/c1-3-4-5(7)6(9)8-2/h5H,3-4H2,1-2H3,(H,8,9)
InChIKeyYHTNZMUPHUDUHY-UHFFFAOYSA-N
MW133.17 g/mol
LogP0.87
Rot. Bonds3

About 2-fluoro-N-methylpentanamide

2-fluoro-N-methylpentanamide (PubChem CID 90374763) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is 2-fluoro-N-methylpentanamide.

Molecular Properties

Compound Name2-fluoro-N-methylpentanamide
PubChem CID90374763
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC Name2-fluoro-N-methylpentanamide
SMILESCCCC(F)C(=O)NC
InChIInChI=1S/C6H12FNO/c1-3-4-5(7)6(9)8-2/h5H,3-4H2,1-2H3,(H,8,9)
InChIKeyYHTNZMUPHUDUHY-UHFFFAOYSA-N
XLogP0.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-Methylbutanamide
CID 28774
N-Methylhexanamide
CID 439790
2,2,3,3,4,4,5,5,5-Nonafluoro-N-methylpentanamide
CID 4086334
N-Methylpentanamide
CID 22591
N-Ethylvaleramide
CID 521484
N-methyl-2-fluoropropanamide
CID 55288492
N-(2,2,2-trifluoroethyl)pentanamide
CID 89487108
N1,N5-Dimethylpentanediamide
CID 14291790
N-2-fluoroamylacetamide
CID 129672677
4-fluoro-N,4-dimethylpentanamide
CID 162409074
N-(Methoxymethyl)pentanamide
CID 12558813
5-amino-N-methylpentanamide
CID 23523808

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methylpentanamide?
The IUPAC name of 2-fluoro-N-methylpentanamide (CID 90374763) is 2-fluoro-N-methylpentanamide.
What is the SMILES notation for 2-fluoro-N-methylpentanamide?
The canonical SMILES for 2-fluoro-N-methylpentanamide is CCCC(F)C(=O)NC.
What is the InChIKey of 2-fluoro-N-methylpentanamide?
The InChIKey is YHTNZMUPHUDUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FNO/c1-3-4-5(7)6(9)8-2/h5H,3-4H2,1-2H3,(H,8,9).
What are the key properties of 2-fluoro-N-methylpentanamide?
2-fluoro-N-methylpentanamide has a molecular weight of 133.17 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methylpentanamide is sourced from PubChem (CID 90374763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).