N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide

C14H14N2O3 — CID 105063699

IUPACN-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)NCc1ccccc1O
InChIInChI=1S/C14H14N2O3/c1-19-13-9-15-7-6-11(13)14(18)16-8-10-4-2-3-5-12(10)17/h2-7,9,17H,8H2,1H3,(H,16,18)
InChIKeyOOSWKNAEUOHQAD-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.73
Rot. Bonds4

About N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide

N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide (PubChem CID 105063699) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide
PubChem CID105063699
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC NameN-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)NCc1ccccc1O
InChIInChI=1S/C14H14N2O3/c1-19-13-9-15-7-6-11(13)14(18)16-8-10-4-2-3-5-12(10)17/h2-7,9,17H,8H2,1H3,(H,16,18)
InChIKeyOOSWKNAEUOHQAD-UHFFFAOYSA-N
XLogP1.73
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-N-[(2-hydroxyphenyl)methyl]pyridine-4-carboxamide
CID 115667770
3-hydrazinyl-N-[(2-methoxyphenyl)methyl]pyridine-4-carboxamide
CID 105071540
3-methoxy-N-(2-methylpropyl)pyridine-4-carboxamide
CID 105063807
3-methoxy-N-[2-(methylamino)ethyl]pyridine-4-carboxamide
CID 105064057
N-(1H-imidazol-2-ylmethyl)-3-methoxypyridine-4-carboxamide
CID 105063994
2-[2-[[(3-hydroxypyridine-4-carbonyl)amino]methyl]phenyl]acetic acid
CID 81439005
N-(4-hydroxybutyl)-3-methoxypyridine-4-carboxamide
CID 106843109
3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
CID 82786350
N-[(2-hydroxyphenyl)methyl]-2-methoxypyridine-3-carboxamide
CID 115598782
N-(3-bromobutyl)-3-methoxypyridine-4-carboxamide
CID 105064561
N-(2-bromo-3-methylbutyl)-3-methoxypyridine-4-carboxamide
CID 105064608
2-amino-3-methoxy-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114698208

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide?
The IUPAC name of N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide (CID 105063699) is N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide.
What is the SMILES notation for N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide?
The canonical SMILES for N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide is COc1cnccc1C(=O)NCc1ccccc1O.
What is the InChIKey of N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide?
The InChIKey is OOSWKNAEUOHQAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-19-13-9-15-7-6-11(13)14(18)16-8-10-4-2-3-5-12(10)17/h2-7,9,17H,8H2,1H3,(H,16,18).
What are the key properties of N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide?
N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxyphenyl)methyl]-3-methoxypyridine-4-carboxamide is sourced from PubChem (CID 105063699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).