4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide

C15H16N2O2 — CID 57449980

IUPAC4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide
SMILESCc1cc(C(=O)NCc2ccccn2)cc(C)c1O
InChIInChI=1S/C15H16N2O2/c1-10-7-12(8-11(2)14(10)18)15(19)17-9-13-5-3-4-6-16-13/h3-8,18H,9H2,1-2H3,(H,17,19)
InChIKeyOCRMAZGNMNVNPN-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.33
Rot. Bonds3

About 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide

4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 57449980) has the molecular formula C15H16N2O2 and a molecular weight of 256.30 g/mol. Its IUPAC name is 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide
PubChem CID57449980
Molecular FormulaC15H16N2O2
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC Name4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide
SMILESCc1cc(C(=O)NCc2ccccn2)cc(C)c1O
InChIInChI=1S/C15H16N2O2/c1-10-7-12(8-11(2)14(10)18)15(19)17-9-13-5-3-4-6-16-13/h3-8,18H,9H2,1-2H3,(H,17,19)
InChIKeyOCRMAZGNMNVNPN-UHFFFAOYSA-N
XLogP2.33
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide (CID 57449980) is 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide is Cc1cc(C(=O)NCc2ccccn2)cc(C)c1O.
What is the InChIKey of 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is OCRMAZGNMNVNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-7-12(8-11(2)14(10)18)15(19)17-9-13-5-3-4-6-16-13/h3-8,18H,9H2,1-2H3,(H,17,19).
What are the key properties of 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide?
4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 256.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3,5-dimethyl-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 57449980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).