4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide

C14H14N2O2 — CID 62307538

IUPAC4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide
SMILESCc1cccc(CNC(=O)c2ccc(O)cc2)n1
InChIInChI=1S/C14H14N2O2/c1-10-3-2-4-12(16-10)9-15-14(18)11-5-7-13(17)8-6-11/h2-8,17H,9H2,1H3,(H,15,18)
InChIKeySTWKDDLLUOXIFP-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.03
Rot. Bonds3

About 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide

4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide (PubChem CID 62307538) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide
PubChem CID62307538
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide
SMILESCc1cccc(CNC(=O)c2ccc(O)cc2)n1
InChIInChI=1S/C14H14N2O2/c1-10-3-2-4-12(16-10)9-15-14(18)11-5-7-13(17)8-6-11/h2-8,17H,9H2,1H3,(H,15,18)
InChIKeySTWKDDLLUOXIFP-UHFFFAOYSA-N
XLogP2.03
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide?
The IUPAC name of 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide (CID 62307538) is 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide.
What is the SMILES notation for 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide?
The canonical SMILES for 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide is Cc1cccc(CNC(=O)c2ccc(O)cc2)n1.
What is the InChIKey of 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide?
The InChIKey is STWKDDLLUOXIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-10-3-2-4-12(16-10)9-15-14(18)11-5-7-13(17)8-6-11/h2-8,17H,9H2,1H3,(H,15,18).
What are the key properties of 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide?
4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide has a molecular weight of 242.28 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(6-methyl-2-pyridinyl)methyl]benzamide is sourced from PubChem (CID 62307538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).