6-fluoro-5-hydroxy-4-methylhexanamide

C7H14FNO2 — CID 118700037

IUPAC6-fluoro-5-hydroxy-4-methylhexanamide
SMILESCC(CCC(N)=O)C(O)CF
InChIInChI=1S/C7H14FNO2/c1-5(6(10)4-8)2-3-7(9)11/h5-6,10H,2-4H2,1H3,(H2,9,11)
InChIKeyZBQLMYUCWYOVGL-UHFFFAOYSA-N
MW163.19 g/mol
LogP0.22
Rot. Bonds5

About 6-fluoro-5-hydroxy-4-methylhexanamide

6-fluoro-5-hydroxy-4-methylhexanamide (PubChem CID 118700037) has the molecular formula C7H14FNO2 and a molecular weight of 163.19 g/mol. Its IUPAC name is 6-fluoro-5-hydroxy-4-methylhexanamide.

Molecular Properties

Compound Name6-fluoro-5-hydroxy-4-methylhexanamide
PubChem CID118700037
Molecular FormulaC7H14FNO2
Molecular Weight163.19 g/mol
Exact Mass163.10
IUPAC Name6-fluoro-5-hydroxy-4-methylhexanamide
SMILESCC(CCC(N)=O)C(O)CF
InChIInChI=1S/C7H14FNO2/c1-5(6(10)4-8)2-3-7(9)11/h5-6,10H,2-4H2,1H3,(H2,9,11)
InChIKeyZBQLMYUCWYOVGL-UHFFFAOYSA-N
XLogP0.22
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(6-amino-1-fluoro-2-hydroxy-6-oxohexan-3-yl)azanium
CID 140699932
2-methylpentanediamide
CID 19688970
(2R)-2-methylpentanediamide
CID 90202517
(4S)-4-amino-5-methylhexanamide
CID 90463437
2-hydroxypentanediamide
CID 559184
2-(2-hydroxypropyl)pentanediamide
CID 23104492
4,7-dimethyloctanamide
CID 16638041
2,8-dihydroxynonan-5-one
CID 174799972
(4R)-4,5-dihydroxypentanamide
CID 140573063
hexanediamide;propane-1,2-diol
CID 175159738
2-hydroxypropanoyl (2S)-2,5-diamino-5-oxopentanoate
CID 87119141
6-hydroxy-5-methylnonan-2-one
CID 58027509

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-5-hydroxy-4-methylhexanamide?
The IUPAC name of 6-fluoro-5-hydroxy-4-methylhexanamide (CID 118700037) is 6-fluoro-5-hydroxy-4-methylhexanamide.
What is the SMILES notation for 6-fluoro-5-hydroxy-4-methylhexanamide?
The canonical SMILES for 6-fluoro-5-hydroxy-4-methylhexanamide is CC(CCC(N)=O)C(O)CF.
What is the InChIKey of 6-fluoro-5-hydroxy-4-methylhexanamide?
The InChIKey is ZBQLMYUCWYOVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO2/c1-5(6(10)4-8)2-3-7(9)11/h5-6,10H,2-4H2,1H3,(H2,9,11).
What are the key properties of 6-fluoro-5-hydroxy-4-methylhexanamide?
6-fluoro-5-hydroxy-4-methylhexanamide has a molecular weight of 163.19 g/mol, XLogP of 0.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-5-hydroxy-4-methylhexanamide is sourced from PubChem (CID 118700037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).