N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide

C14H11ClFNO2 — CID 104916625

IUPACN-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide
SMILESO=C(NCc1cccc(Cl)c1)c1c(O)cccc1F
InChIInChI=1S/C14H11ClFNO2/c15-10-4-1-3-9(7-10)8-17-14(19)13-11(16)5-2-6-12(13)18/h1-7,18H,8H2,(H,17,19)
InChIKeyUPORGAWNUJSVRG-UHFFFAOYSA-N
MW279.70 g/mol
LogP3.11
Rot. Bonds3

About N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide

N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide (PubChem CID 104916625) has the molecular formula C14H11ClFNO2 and a molecular weight of 279.70 g/mol. Its IUPAC name is N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide.

Molecular Properties

Compound NameN-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide
PubChem CID104916625
Molecular FormulaC14H11ClFNO2
Molecular Weight279.70 g/mol
Exact Mass279.05
IUPAC NameN-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide
SMILESO=C(NCc1cccc(Cl)c1)c1c(O)cccc1F
InChIInChI=1S/C14H11ClFNO2/c15-10-4-1-3-9(7-10)8-17-14(19)13-11(16)5-2-6-12(13)18/h1-7,18H,8H2,(H,17,19)
InChIKeyUPORGAWNUJSVRG-UHFFFAOYSA-N
XLogP3.11
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.70
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[(3-chlorophenyl)methyl]-6-fluorobenzamide
CID 2679700
5-chloro-N-[(3-chlorophenyl)methyl]-2-fluorobenzamide
CID 9079628
N-[(3-bromophenyl)methyl]-2-fluoro-6-hydroxybenzamide
CID 104917207
N-[(3-chlorophenyl)methyl]-2-hydroxybenzamide
CID 18105910
N-[(3-chlorophenyl)methyl]-4-fluoro-2-hydroxybenzamide
CID 103829577
N-[(3-chlorophenyl)methyl]-3,4,5-trifluorobenzamide
CID 63188835
N-[(4-bromophenyl)methyl]-2-fluoro-6-hydroxybenzamide
CID 104917477
2-amino-4-chloro-N-[(3-chlorophenyl)methyl]benzamide
CID 61111340
N-[[3-(bromomethyl)phenyl]methyl]-2,6-difluorobenzamide
CID 114313059
N-[(2S)-1-[(3-chlorophenyl)methylamino]-3-methyl-1-oxobutan-2-yl]-2,6-difluorobenzamide
CID 24537098
3-(2-chloro-6-fluorophenyl)-N-[(3-chlorophenyl)methyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 9209822
N-[(3-chlorophenyl)methyl]-4-fluoro-2-methylbenzamide
CID 113268545

Frequently Asked Questions

What is the IUPAC name of N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide?
The IUPAC name of N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide (CID 104916625) is N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide.
What is the SMILES notation for N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide?
The canonical SMILES for N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide is O=C(NCc1cccc(Cl)c1)c1c(O)cccc1F.
What is the InChIKey of N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide?
The InChIKey is UPORGAWNUJSVRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO2/c15-10-4-1-3-9(7-10)8-17-14(19)13-11(16)5-2-6-12(13)18/h1-7,18H,8H2,(H,17,19).
What are the key properties of N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide?
N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide has a molecular weight of 279.70 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-chlorophenyl)methyl]-2-fluoro-6-hydroxybenzamide is sourced from PubChem (CID 104916625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).