N-(2,3-difluorophenyl)-4-hydroxypentanamide

C11H13F2NO2 — CID 79193547

IUPACN-(2,3-difluorophenyl)-4-hydroxypentanamide
SMILESCC(O)CCC(=O)Nc1cccc(F)c1F
InChIInChI=1S/C11H13F2NO2/c1-7(15)5-6-10(16)14-9-4-2-3-8(12)11(9)13/h2-4,7,15H,5-6H2,1H3,(H,14,16)
InChIKeyRHYSSXNQHBXGIT-UHFFFAOYSA-N
MW229.23 g/mol
LogP2.06
Rot. Bonds4

About N-(2,3-difluorophenyl)-4-hydroxypentanamide

N-(2,3-difluorophenyl)-4-hydroxypentanamide (PubChem CID 79193547) has the molecular formula C11H13F2NO2 and a molecular weight of 229.23 g/mol. Its IUPAC name is N-(2,3-difluorophenyl)-4-hydroxypentanamide.

Molecular Properties

Compound NameN-(2,3-difluorophenyl)-4-hydroxypentanamide
PubChem CID79193547
Molecular FormulaC11H13F2NO2
Molecular Weight229.23 g/mol
Exact Mass229.09
IUPAC NameN-(2,3-difluorophenyl)-4-hydroxypentanamide
SMILESCC(O)CCC(=O)Nc1cccc(F)c1F
InChIInChI=1S/C11H13F2NO2/c1-7(15)5-6-10(16)14-9-4-2-3-8(12)11(9)13/h2-4,7,15H,5-6H2,1H3,(H,14,16)
InChIKeyRHYSSXNQHBXGIT-UHFFFAOYSA-N
XLogP2.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluoro-2-methylphenyl)-4-hydroxypentanamide
CID 79192494
4-hydroxy-N-(2-methylphenyl)pentanamide
CID 79017195
N-(4-chloro-2-fluorophenyl)-4-hydroxypentanamide
CID 79191552
3-amino-N-(2,3-difluorophenyl)-3-methylbutanamide
CID 64678372
2-fluoro-6-(4-methylpentanoylamino)benzoic acid
CID 43442857
ethyl 3-(2,3-difluoroanilino)-3-oxopropanoate
CID 110474181
3-(4-hydroxypentanoylamino)-N,2-dimethylbenzamide
CID 79204866
2-amino-N-(2,3-difluorophenyl)-3-methylbutanamide;hydrochloride
CID 119280847
[[2-(2,3-difluoroanilino)-2-oxoethyl]amino]carbamic acid
CID 69121080
N-(2,3-difluorophenyl)-N'-(1-hydroxypropan-2-yl)oxamide
CID 47457392
N-[2-[(dimethylamino)methyl]phenyl]-4-hydroxypentanamide
CID 79204978
2-[(2,3-difluorophenyl)carbamoylamino]-3-methylbutanoic acid
CID 61207863

Frequently Asked Questions

What is the IUPAC name of N-(2,3-difluorophenyl)-4-hydroxypentanamide?
The IUPAC name of N-(2,3-difluorophenyl)-4-hydroxypentanamide (CID 79193547) is N-(2,3-difluorophenyl)-4-hydroxypentanamide.
What is the SMILES notation for N-(2,3-difluorophenyl)-4-hydroxypentanamide?
The canonical SMILES for N-(2,3-difluorophenyl)-4-hydroxypentanamide is CC(O)CCC(=O)Nc1cccc(F)c1F.
What is the InChIKey of N-(2,3-difluorophenyl)-4-hydroxypentanamide?
The InChIKey is RHYSSXNQHBXGIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2NO2/c1-7(15)5-6-10(16)14-9-4-2-3-8(12)11(9)13/h2-4,7,15H,5-6H2,1H3,(H,14,16).
What are the key properties of N-(2,3-difluorophenyl)-4-hydroxypentanamide?
N-(2,3-difluorophenyl)-4-hydroxypentanamide has a molecular weight of 229.23 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-difluorophenyl)-4-hydroxypentanamide is sourced from PubChem (CID 79193547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).