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

C15H15FN2O2 — CID 115299371

IUPACN-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide
SMILESNCc1ccccc1CNC(=O)c1cc(F)ccc1O
InChIInChI=1S/C15H15FN2O2/c16-12-5-6-14(19)13(7-12)15(20)18-9-11-4-2-1-3-10(11)8-17/h1-7,19H,8-9,17H2,(H,18,20)
InChIKeyRXXCZLRTAXTALJ-UHFFFAOYSA-N
MW274.30 g/mol
LogP1.92
Rot. Bonds4

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

N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide (PubChem CID 115299371) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide
PubChem CID115299371
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC NameN-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide
SMILESNCc1ccccc1CNC(=O)c1cc(F)ccc1O
InChIInChI=1S/C15H15FN2O2/c16-12-5-6-14(19)13(7-12)15(20)18-9-11-4-2-1-3-10(11)8-17/h1-7,19H,8-9,17H2,(H,18,20)
InChIKeyRXXCZLRTAXTALJ-UHFFFAOYSA-N
XLogP1.92
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-ethylphenyl)methyl]-5-fluoro-2-hydroxybenzamide
CID 115299129
N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide
CID 115299411
N-[(2,5-difluorophenyl)methyl]-5-fluoro-2-hydroxybenzamide
CID 79880980
5-fluoro-N-[(2-hydroxyphenyl)methyl]-2-methylbenzamide
CID 115598801
N-[[2-(aminomethyl)phenyl]methyl]-4-chloro-2,5-difluorobenzamide
CID 82771924
N-[[2-(aminomethyl)phenyl]methyl]-3,4,5-trifluorobenzamide
CID 63186443
2-[[2-(aminomethyl)phenyl]methylamino]-5-fluorobenzamide
CID 63673130
5-fluoro-2-hydroxy-N-[(4-methylthiophen-3-yl)methyl]benzamide
CID 115299175
5-fluoro-N-[(2-hydroxyphenyl)methyl]-2-nitrobenzamide
CID 115735454
N-ethyl-5-fluoro-2-hydroxybenzamide
CID 79531934
N-[[2-(aminomethyl)phenyl]methyl]-2-chloro-3-fluorobenzamide
CID 81461744
5-bromo-N-[(2-fluorophenyl)methyl]-2-hydroxybenzamide
CID 27163577

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide?
The IUPAC name of N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide (CID 115299371) is N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide is NCc1ccccc1CNC(=O)c1cc(F)ccc1O.
What is the InChIKey of N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide?
The InChIKey is RXXCZLRTAXTALJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c16-12-5-6-14(19)13(7-12)15(20)18-9-11-4-2-1-3-10(11)8-17/h1-7,19H,8-9,17H2,(H,18,20).
What are the key properties of N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide?
N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide has a molecular weight of 274.30 g/mol, XLogP of 1.92, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)phenyl]methyl]-5-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 115299371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).