5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide

C14H10ClF2NO2 — CID 60739890

IUPAC5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide
SMILESO=C(NCc1ccc(F)c(F)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C14H10ClF2NO2/c15-9-2-4-13(19)10(6-9)14(20)18-7-8-1-3-11(16)12(17)5-8/h1-6,19H,7H2,(H,18,20)
InChIKeyKAIFJYWGLXDYNX-UHFFFAOYSA-N
MW297.69 g/mol
LogP3.25
Rot. Bonds3

About 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide

5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide (PubChem CID 60739890) has the molecular formula C14H10ClF2NO2 and a molecular weight of 297.69 g/mol. Its IUPAC name is 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide
PubChem CID60739890
Molecular FormulaC14H10ClF2NO2
Molecular Weight297.69 g/mol
Exact Mass297.04
IUPAC Name5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide
SMILESO=C(NCc1ccc(F)c(F)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C14H10ClF2NO2/c15-9-2-4-13(19)10(6-9)14(20)18-7-8-1-3-11(16)12(17)5-8/h1-6,19H,7H2,(H,18,20)
InChIKeyKAIFJYWGLXDYNX-UHFFFAOYSA-N
XLogP3.25
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.69
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-hydroxy-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
CID 18225179
5-chloro-N-(furan-3-ylmethyl)-2-hydroxybenzamide
CID 47204985
4-chloro-N-[(3,4-difluorophenyl)methyl]pyridine-3-carboxamide
CID 81227434
methyl N-[4-[[(5-chloro-2-hydroxybenzoyl)amino]methyl]phenyl]carbamate
CID 47058003
5-chloro-N-[(3-chlorophenyl)methyl]-2-fluorobenzamide
CID 9079628
5-chloro-2-fluoro-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107230315
3-chloro-N-[(3,4-difluorophenyl)methyl]pyridine-4-carboxamide
CID 66482974
3-amino-2-chloro-N-[(3,4-difluorophenyl)methyl]benzamide
CID 115930472
5-chloro-N-[(3,4-difluorophenyl)methyl]furan-2-carboxamide
CID 103612091
N,N'-bis[(3,4-difluorophenyl)methyl]oxamide
CID 126500404
2-[(5-chloro-2-hydroxybenzoyl)amino]acetic acid
CID 15858288
5-amino-N-[(3,4-difluorophenyl)methyl]-2,4-dimethylbenzamide
CID 102705403

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide (CID 60739890) is 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide is O=C(NCc1ccc(F)c(F)c1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide?
The InChIKey is KAIFJYWGLXDYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF2NO2/c15-9-2-4-13(19)10(6-9)14(20)18-7-8-1-3-11(16)12(17)5-8/h1-6,19H,7H2,(H,18,20).
What are the key properties of 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide?
5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide has a molecular weight of 297.69 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(3,4-difluorophenyl)methyl]-2-hydroxybenzamide is sourced from PubChem (CID 60739890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).