2-fluoro-2-methylpentanamide

C6H12FNO — CID 134346431

IUPAC2-fluoro-2-methylpentanamide
SMILESCCCC(C)(F)C(N)=O
InChIInChI=1S/C6H12FNO/c1-3-4-6(2,7)5(8)9/h3-4H2,1-2H3,(H2,8,9)
InChIKeyOMROABOTJFCIHS-UHFFFAOYSA-N
MW133.17 g/mol
LogP1.00
Rot. Bonds3

About 2-fluoro-2-methylpentanamide

2-fluoro-2-methylpentanamide (PubChem CID 134346431) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is 2-fluoro-2-methylpentanamide.

Molecular Properties

Compound Name2-fluoro-2-methylpentanamide
PubChem CID134346431
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC Name2-fluoro-2-methylpentanamide
SMILESCCCC(C)(F)C(N)=O
InChIInChI=1S/C6H12FNO/c1-3-4-6(2,7)5(8)9/h3-4H2,1-2H3,(H2,8,9)
InChIKeyOMROABOTJFCIHS-UHFFFAOYSA-N
XLogP1.00
TPSA43.09 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 ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-fluoro-2-methyl-4-sulfanylbutanamide
CID 130198971
3-fluoro-3-methylhexan-2-one
CID 157210993
ethyl 2-fluoro-2-methylpentanoate
CID 157367290
2-ethyl-2-methylpentanamide
CID 22376566
[2-(carbamoyloxymethyl)-2-methylpentyl] carbamate
CID 4064
4-methyl-4-propylheptanamide
CID 90273698
2-ethyl-2-propylpentanamide
CID 10352144
propyl 3-amino-4-fluoro-4-methylhept-2-enoate
CID 139829355
(2S)-2-fluoro-2-methylbutanoic acid
CID 18651777
2-fluoro-2-methylbutanoic acid
CID 11366977
acetic acid;[2-(carbamoyloxymethyl)-2-methylpentyl] carbamate
CID 18352582
2,2-dimethyldecanamide
CID 22596903

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methylpentanamide?
The IUPAC name of 2-fluoro-2-methylpentanamide (CID 134346431) is 2-fluoro-2-methylpentanamide.
What is the SMILES notation for 2-fluoro-2-methylpentanamide?
The canonical SMILES for 2-fluoro-2-methylpentanamide is CCCC(C)(F)C(N)=O.
What is the InChIKey of 2-fluoro-2-methylpentanamide?
The InChIKey is OMROABOTJFCIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FNO/c1-3-4-6(2,7)5(8)9/h3-4H2,1-2H3,(H2,8,9).
What are the key properties of 2-fluoro-2-methylpentanamide?
2-fluoro-2-methylpentanamide has a molecular weight of 133.17 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methylpentanamide is sourced from PubChem (CID 134346431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).