N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide

C12H16FNO2 — CID 79192494

IUPACN-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide
SMILESCc1c(F)cccc1NC(=O)CCC(C)O
InChIInChI=1S/C12H16FNO2/c1-8(15)6-7-12(16)14-11-5-3-4-10(13)9(11)2/h3-5,8,15H,6-7H2,1-2H3,(H,14,16)
InChIKeyWLJXTNLPZGIUCX-UHFFFAOYSA-N
MW225.26 g/mol
LogP2.23
Rot. Bonds4

About N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide

N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide (PubChem CID 79192494) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide.

Molecular Properties

Compound NameN-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide
PubChem CID79192494
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC NameN-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide
SMILESCc1c(F)cccc1NC(=O)CCC(C)O
InChIInChI=1S/C12H16FNO2/c1-8(15)6-7-12(16)14-11-5-3-4-10(13)9(11)2/h3-5,8,15H,6-7H2,1-2H3,(H,14,16)
InChIKeyWLJXTNLPZGIUCX-UHFFFAOYSA-N
XLogP2.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-difluorophenyl)-4-hydroxypentanamide
CID 79193547
4-amino-N-(3-fluoro-2-methylphenyl)-4-phenylbutanamide
CID 63324007
3-(4-hydroxypentanoylamino)-N,2-dimethylbenzamide
CID 79204866
4-hydroxy-N-(2-methylphenyl)pentanamide
CID 79017195
N-(5-cyano-3-fluoro-2-methylphenyl)-4-hydroxypentanamide
CID 79200626
3-amino-N-(3-fluoro-2-methylphenyl)-3-methylbutanamide
CID 64678036
N-(4-chloro-2-fluorophenyl)-4-hydroxypentanamide
CID 79191552
2,2-difluoro-N-(3-fluoro-2-methylphenyl)acetamide
CID 103515626
2-fluoro-6-(4-methylpentanoylamino)benzoic acid
CID 43442857
4-(3-fluoro-2-methylanilino)-2,3-dimethyl-4-oxobutanoic acid
CID 103498147
4-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pentanamide
CID 79203586
N-(3-fluoro-2-methylphenyl)-N'-(1-hydroxypropan-2-yl)oxamide
CID 111521413

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide?
The IUPAC name of N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide (CID 79192494) is N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide.
What is the SMILES notation for N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide?
The canonical SMILES for N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide is Cc1c(F)cccc1NC(=O)CCC(C)O.
What is the InChIKey of N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide?
The InChIKey is WLJXTNLPZGIUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c1-8(15)6-7-12(16)14-11-5-3-4-10(13)9(11)2/h3-5,8,15H,6-7H2,1-2H3,(H,14,16).
What are the key properties of N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide?
N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide has a molecular weight of 225.26 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide is sourced from PubChem (CID 79192494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).