N-(2,6-difluoro-3-hydroxyphenyl)propanamide

C9H9F2NO2 — CID 170212075

IUPACN-(2,6-difluoro-3-hydroxyphenyl)propanamide
SMILESCCC(=O)Nc1c(F)ccc(O)c1F
InChIInChI=1S/C9H9F2NO2/c1-2-7(14)12-9-5(10)3-4-6(13)8(9)11/h3-4,13H,2H2,1H3,(H,12,14)
InChIKeyMFDFUQSXVVENHY-UHFFFAOYSA-N
MW201.17 g/mol
LogP2.02
Rot. Bonds2

About N-(2,6-difluoro-3-hydroxyphenyl)propanamide

N-(2,6-difluoro-3-hydroxyphenyl)propanamide (PubChem CID 170212075) has the molecular formula C9H9F2NO2 and a molecular weight of 201.17 g/mol. Its IUPAC name is N-(2,6-difluoro-3-hydroxyphenyl)propanamide.

Molecular Properties

Compound NameN-(2,6-difluoro-3-hydroxyphenyl)propanamide
PubChem CID170212075
Molecular FormulaC9H9F2NO2
Molecular Weight201.17 g/mol
Exact Mass201.06
IUPAC NameN-(2,6-difluoro-3-hydroxyphenyl)propanamide
SMILESCCC(=O)Nc1c(F)ccc(O)c1F
InChIInChI=1S/C9H9F2NO2/c1-2-7(14)12-9-5(10)3-4-6(13)8(9)11/h3-4,13H,2H2,1H3,(H,12,14)
InChIKeyMFDFUQSXVVENHY-UHFFFAOYSA-N
XLogP2.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.17
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-difluoro-3-methylphenyl)propanamide
CID 82820072
2,4-difluoro-3-(methylamino)phenol
CID 18457325
3-(2,6-difluoro-3-methylanilino)-3-oxopropanoic acid
CID 82820377
N-(3,4-difluorophenyl)propanamide
CID 4285365
5-bromo-N-(2,6-difluoro-3-hydroxyphenyl)-2-fluorobenzamide
CID 89443501
N-(2,6-difluoro-3-methylphenyl)-4-hydroxybutanamide
CID 82819991
N-(2,6-difluoro-3-methylphenyl)-2-(3-hydroxyphenyl)acetamide
CID 82819723
N-(4-fluoro-2,6-dimethylphenyl)propanamide;yttrium
CID 159722509
4-amino-N-(2,6-difluoro-3-methylphenyl)-4-methylpentanamide
CID 82819149
N-(2,6-difluoro-3-methylphenyl)-2-(prop-2-ynylamino)acetamide
CID 82817941
N-(2,6-difluoro-3-methylphenyl)-2,5-dihydroxybenzamide
CID 107723516
N-(3-chloro-4-fluoro-2-methylphenyl)propanamide
CID 159195412

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluoro-3-hydroxyphenyl)propanamide?
The IUPAC name of N-(2,6-difluoro-3-hydroxyphenyl)propanamide (CID 170212075) is N-(2,6-difluoro-3-hydroxyphenyl)propanamide.
What is the SMILES notation for N-(2,6-difluoro-3-hydroxyphenyl)propanamide?
The canonical SMILES for N-(2,6-difluoro-3-hydroxyphenyl)propanamide is CCC(=O)Nc1c(F)ccc(O)c1F.
What is the InChIKey of N-(2,6-difluoro-3-hydroxyphenyl)propanamide?
The InChIKey is MFDFUQSXVVENHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F2NO2/c1-2-7(14)12-9-5(10)3-4-6(13)8(9)11/h3-4,13H,2H2,1H3,(H,12,14).
What are the key properties of N-(2,6-difluoro-3-hydroxyphenyl)propanamide?
N-(2,6-difluoro-3-hydroxyphenyl)propanamide has a molecular weight of 201.17 g/mol, XLogP of 2.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluoro-3-hydroxyphenyl)propanamide is sourced from PubChem (CID 170212075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).