N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide

C14H13FN2O2 — CID 115299411

IUPACN-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide
SMILESNCc1ccccc1NC(=O)c1cc(F)ccc1O
InChIInChI=1S/C14H13FN2O2/c15-10-5-6-13(18)11(7-10)14(19)17-12-4-2-1-3-9(12)8-16/h1-7,18H,8,16H2,(H,17,19)
InChIKeyZNJSIBUSDPUNPW-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.24
Rot. Bonds3

About N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide

N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide (PubChem CID 115299411) has the molecular formula C14H13FN2O2 and a molecular weight of 260.27 g/mol. Its IUPAC name is N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide
PubChem CID115299411
Molecular FormulaC14H13FN2O2
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC NameN-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide
SMILESNCc1ccccc1NC(=O)c1cc(F)ccc1O
InChIInChI=1S/C14H13FN2O2/c15-10-5-6-13(18)11(7-10)14(19)17-12-4-2-1-3-9(12)8-16/h1-7,18H,8,16H2,(H,17,19)
InChIKeyZNJSIBUSDPUNPW-UHFFFAOYSA-N
XLogP2.24
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-5-fluoro-2-hydroxybenzamide
CID 115298874
N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide
CID 115299371
5-fluoro-2-hydroxy-N-(2-sulfamoylphenyl)benzamide
CID 115299526
N-(2-amino-4-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298308
N-(2-amino-5-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298392
N-[2-(bromomethyl)phenyl]-2,5-difluorobenzamide
CID 113274477
N-[2-(aminomethyl)phenyl]-2-chloro-5-hydroxybenzamide
CID 106502622
N-[2-(aminomethyl)phenyl]-2-iodobenzamide
CID 64882136
5-fluoro-2-[(5-fluoro-2-hydroxybenzoyl)amino]benzoic acid
CID 115298431
N-(2-carbamothioyl-4-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 82683463
N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide
CID 16772682
N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide
CID 107705031

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide?
The IUPAC name of N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide (CID 115299411) is N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide is NCc1ccccc1NC(=O)c1cc(F)ccc1O.
What is the InChIKey of N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide?
The InChIKey is ZNJSIBUSDPUNPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2/c15-10-5-6-13(18)11(7-10)14(19)17-12-4-2-1-3-9(12)8-16/h1-7,18H,8,16H2,(H,17,19).
What are the key properties of N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide?
N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide has a molecular weight of 260.27 g/mol, XLogP of 2.24, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 115299411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).