2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide

C14H11F2NO2 — CID 64793823

IUPAC2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(F)ccc2F)cc1O
InChIInChI=1S/C14H11F2NO2/c1-8-2-4-10(7-13(8)18)17-14(19)11-6-9(15)3-5-12(11)16/h2-7,18H,1H3,(H,17,19)
InChIKeyBVBAQJBQVGNJPU-UHFFFAOYSA-N
MW263.24 g/mol
LogP3.23
Rot. Bonds2

About 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide

2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide (PubChem CID 64793823) has the molecular formula C14H11F2NO2 and a molecular weight of 263.24 g/mol. Its IUPAC name is 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide.

Molecular Properties

Compound Name2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide
PubChem CID64793823
Molecular FormulaC14H11F2NO2
Molecular Weight263.24 g/mol
Exact Mass263.08
IUPAC Name2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(F)ccc2F)cc1O
InChIInChI=1S/C14H11F2NO2/c1-8-2-4-10(7-13(8)18)17-14(19)11-6-9(15)3-5-12(11)16/h2-7,18H,1H3,(H,17,19)
InChIKeyBVBAQJBQVGNJPU-UHFFFAOYSA-N
XLogP3.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.24
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-2-fluoro-N-(3-hydroxy-4-methylphenyl)benzamide
CID 64793080
2-fluoro-N-(3-hydroxy-4-methylphenyl)benzamide
CID 5163915
2,5-difluoro-N-[4-methyl-3-(trifluoromethyl)phenyl]benzamide
CID 24573056
5-amino-2,4-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide
CID 107699288
3-amino-2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide
CID 107699274
N-(4-chlorophenyl)-5-fluoro-2-methylbenzamide
CID 34753639
N-(3-bromo-4-fluorophenyl)-2,5-difluorobenzamide
CID 115661483
N-(3-chloro-4-methylphenyl)-5-fluoro-2-hydroxybenzamide
CID 115298821
3-fluoro-N-(3-hydroxy-4-methylphenyl)benzamide
CID 837703
2-fluoro-5-[(3-hydroxy-4-methylbenzoyl)amino]benzoic acid
CID 60825323
2,5-difluoro-N-(4-methylsulfanylphenyl)benzamide
CID 42370376
5-[(5-fluoro-2-methylbenzoyl)amino]-2-methylbenzoic acid
CID 63652796

Frequently Asked Questions

What is the IUPAC name of 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide?
The IUPAC name of 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide (CID 64793823) is 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide.
What is the SMILES notation for 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide?
The canonical SMILES for 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide is Cc1ccc(NC(=O)c2cc(F)ccc2F)cc1O.
What is the InChIKey of 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide?
The InChIKey is BVBAQJBQVGNJPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2NO2/c1-8-2-4-10(7-13(8)18)17-14(19)11-6-9(15)3-5-12(11)16/h2-7,18H,1H3,(H,17,19).
What are the key properties of 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide?
2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide has a molecular weight of 263.24 g/mol, XLogP of 3.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide is sourced from PubChem (CID 64793823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).