N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide

C14H10F3NO2 — CID 79880980

IUPACN-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide
SMILESO=C(NCc1cc(F)ccc1F)c1cc(F)ccc1O
InChIInChI=1S/C14H10F3NO2/c15-9-1-3-12(17)8(5-9)7-18-14(20)11-6-10(16)2-4-13(11)19/h1-6,19H,7H2,(H,18,20)
InChIKeyYFMYGEAXKAULRA-UHFFFAOYSA-N
MW281.23 g/mol
LogP2.74
Rot. Bonds3

About N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide

N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide (PubChem CID 79880980) has the molecular formula C14H10F3NO2 and a molecular weight of 281.23 g/mol. Its IUPAC name is N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide
PubChem CID79880980
Molecular FormulaC14H10F3NO2
Molecular Weight281.23 g/mol
Exact Mass281.07
IUPAC NameN-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide
SMILESO=C(NCc1cc(F)ccc1F)c1cc(F)ccc1O
InChIInChI=1S/C14H10F3NO2/c15-9-1-3-12(17)8(5-9)7-18-14(20)11-6-10(16)2-4-13(11)19/h1-6,19H,7H2,(H,18,20)
InChIKeyYFMYGEAXKAULRA-UHFFFAOYSA-N
XLogP2.74
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.23
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide
CID 115299129
N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide
CID 115299371
2-amino-N-[(2,5-difluorophenyl)methyl]-4,5-difluorobenzamide
CID 63794966
N-[(2,5-difluorophenyl)methyl]-2-fluoro-5-sulfanylbenzamide
CID 107030046
N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
CID 63373922
5-fluoro-2-hydroxy-N-[(4-methylthiophen-3-yl)methyl]benzamide
CID 115299175
N-ethyl-5-fluoro-2-hydroxybenzamide
CID 79531934
N-[(2,5-difluorophenyl)methyl]-3-hydroxypyridine-2-carboxamide
CID 55225527
N-[(2,5-difluorophenyl)methyl]-3-fluoropyridine-4-carboxamide
CID 115646128
2-amino-4-chloro-N-[(2,5-difluorophenyl)methyl]benzamide
CID 63794440
2,5-dibromo-N-[(2,5-difluorophenyl)methyl]benzamide
CID 114372361
(2,5-difluorophenyl)methylcarbamic acid
CID 21076562

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide?
The IUPAC name of N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide (CID 79880980) is N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide is O=C(NCc1cc(F)ccc1F)c1cc(F)ccc1O.
What is the InChIKey of N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide?
The InChIKey is YFMYGEAXKAULRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3NO2/c15-9-1-3-12(17)8(5-9)7-18-14(20)11-6-10(16)2-4-13(11)19/h1-6,19H,7H2,(H,18,20).
What are the key properties of N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide?
N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide has a molecular weight of 281.23 g/mol, XLogP of 2.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 79880980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).