4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide

C14H15N3O2 — CID 114332705

IUPAC4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cc(NCc2ccccc2O)ccn1
InChIInChI=1S/C14H15N3O2/c1-15-14(19)12-8-11(6-7-16-12)17-9-10-4-2-3-5-13(10)18/h2-8,18H,9H2,1H3,(H,15,19)(H,16,17)
InChIKeyBJYWWHZFVUROKY-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.76
Rot. Bonds4

About 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide

4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide (PubChem CID 114332705) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide
PubChem CID114332705
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cc(NCc2ccccc2O)ccn1
InChIInChI=1S/C14H15N3O2/c1-15-14(19)12-8-11(6-7-16-12)17-9-10-4-2-3-5-13(10)18/h2-8,18H,9H2,1H3,(H,15,19)(H,16,17)
InChIKeyBJYWWHZFVUROKY-UHFFFAOYSA-N
XLogP1.76
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

Analyze 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide 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

4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 64695920
N-methyl-4-[2-(2-methylphenyl)ethylamino]pyridine-2-carboxamide
CID 112722856
4-[(1,5-dimethylpyrazol-4-yl)methylamino]-N-methylpyridine-2-carboxamide
CID 106048173
4-[(4-aminophenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 60874908
4-[(4-chlorophenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 43395704
4-[(2-bromophenyl)methylamino]-N-ethylpyridine-2-carboxamide
CID 61401901
3-[[[2-(methylcarbamoyl)-4-pyridinyl]amino]methyl]benzoic acid
CID 60893530
4-[(2-chlorophenyl)methylamino]-N-ethylpyridine-2-carboxamide
CID 43517871
N-methyl-4-[(5-methylpyrazin-2-yl)methylamino]pyridine-2-carboxamide
CID 62845761
4-[(2-chlorophenyl)methylamino]-N-propylpyridine-2-carboxamide
CID 109201013
4-[(2-chloro-3,4-dimethoxyphenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 167797791
N-(2-methoxyethyl)-4-[(2-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109205668

Frequently Asked Questions

What is the IUPAC name of 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide (CID 114332705) is 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide is CNC(=O)c1cc(NCc2ccccc2O)ccn1.
What is the InChIKey of 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide?
The InChIKey is BJYWWHZFVUROKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-15-14(19)12-8-11(6-7-16-12)17-9-10-4-2-3-5-13(10)18/h2-8,18H,9H2,1H3,(H,15,19)(H,16,17).
What are the key properties of 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide?
4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.76, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 114332705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).