2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide

C14H14N2O3 — CID 29050560

IUPAC2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide
SMILESCOc1ccc(C(=O)NCc2cccnc2)c(O)c1
InChIInChI=1S/C14H14N2O3/c1-19-11-4-5-12(13(17)7-11)14(18)16-9-10-3-2-6-15-8-10/h2-8,17H,9H2,1H3,(H,16,18)
InChIKeySJWGXRPUGOBXSJ-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.73
Rot. Bonds4

About 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide

2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 29050560) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide
PubChem CID29050560
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide
SMILESCOc1ccc(C(=O)NCc2cccnc2)c(O)c1
InChIInChI=1S/C14H14N2O3/c1-19-11-4-5-12(13(17)7-11)14(18)16-9-10-3-2-6-15-8-10/h2-8,17H,9H2,1H3,(H,16,18)
InChIKeySJWGXRPUGOBXSJ-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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide (CID 29050560) is 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide is COc1ccc(C(=O)NCc2cccnc2)c(O)c1.
What is the InChIKey of 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is SJWGXRPUGOBXSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-19-11-4-5-12(13(17)7-11)14(18)16-9-10-3-2-6-15-8-10/h2-8,17H,9H2,1H3,(H,16,18).
What are the key properties of 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide?
2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide 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 2-hydroxy-4-methoxy-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 29050560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).