N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide

C14H14N2O2 — CID 60727615

IUPACN-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccc(C)n2)c(O)c1
InChIInChI=1S/C14H14N2O2/c1-9-6-7-11(13(17)8-9)16-14(18)12-5-3-4-10(2)15-12/h3-8,17H,1-2H3,(H,16,18)
InChIKeyFOQVDHPGUWWGOF-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.66
Rot. Bonds2

About N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide

N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide (PubChem CID 60727615) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide
PubChem CID60727615
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC NameN-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccc(C)n2)c(O)c1
InChIInChI=1S/C14H14N2O2/c1-9-6-7-11(13(17)8-9)16-14(18)12-5-3-4-10(2)15-12/h3-8,17H,1-2H3,(H,16,18)
InChIKeyFOQVDHPGUWWGOF-UHFFFAOYSA-N
XLogP2.66
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide?
The IUPAC name of N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide (CID 60727615) is N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide is Cc1ccc(NC(=O)c2cccc(C)n2)c(O)c1.
What is the InChIKey of N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide?
The InChIKey is FOQVDHPGUWWGOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-9-6-7-11(13(17)8-9)16-14(18)12-5-3-4-10(2)15-12/h3-8,17H,1-2H3,(H,16,18).
What are the key properties of N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide?
N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 2.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylphenyl)-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 60727615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).