N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide

C14H14N2O3 — CID 107705031

IUPACN-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide
SMILESNCc1ccccc1NC(=O)c1cc(O)cc(O)c1
InChIInChI=1S/C14H14N2O3/c15-8-9-3-1-2-4-13(9)16-14(19)10-5-11(17)7-12(18)6-10/h1-7,17-18H,8,15H2,(H,16,19)
InChIKeyRLJKHPDQOSSOHU-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.81
Rot. Bonds3

About N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide

N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide (PubChem CID 107705031) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide
PubChem CID107705031
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC NameN-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide
SMILESNCc1ccccc1NC(=O)c1cc(O)cc(O)c1
InChIInChI=1S/C14H14N2O3/c15-8-9-3-1-2-4-13(9)16-14(19)10-5-11(17)7-12(18)6-10/h1-7,17-18H,8,15H2,(H,16,19)
InChIKeyRLJKHPDQOSSOHU-UHFFFAOYSA-N
XLogP1.81
TPSA95.58 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(bromomethyl)phenyl]-3,5-dihydroxybenzamide
CID 107706038
N-[2-(aminomethyl)phenyl]-5-hydroxypyridine-3-carboxamide
CID 64895437
N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide
CID 16772682
N-[2-(aminomethyl)phenyl]-3-bromo-5-methylbenzamide
CID 115999651
N-[2-(aminomethyl)phenyl]-2-chloro-5-hydroxybenzamide
CID 106502622
N-[2-(aminomethyl)phenyl]quinoxaline-6-carboxamide
CID 63754296
N-[2-(aminomethyl)phenyl]-4-bromo-3-chlorobenzamide
CID 81295178
N-[2-(aminomethyl)phenyl]-2-iodobenzamide
CID 64882136
N-[2-(aminomethyl)phenyl]carbamoyl chloride
CID 142823786
N-[2-(aminomethyl)phenyl]-5-fluoro-2-hydroxybenzamide
CID 115299411
N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide
CID 16773462
4-(aminomethyl)-N-(2-ethylphenyl)benzamide
CID 16782121

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide?
The IUPAC name of N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide (CID 107705031) is N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide.
What is the SMILES notation for N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide?
The canonical SMILES for N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide is NCc1ccccc1NC(=O)c1cc(O)cc(O)c1.
What is the InChIKey of N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide?
The InChIKey is RLJKHPDQOSSOHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c15-8-9-3-1-2-4-13(9)16-14(19)10-5-11(17)7-12(18)6-10/h1-7,17-18H,8,15H2,(H,16,19).
What are the key properties of N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide?
N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide has a molecular weight of 258.28 g/mol, XLogP of 1.81, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide is sourced from PubChem (CID 107705031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).