5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide

C13H12N2O3 — CID 115621996

IUPAC5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(O)cc1)c1cncc(O)c1
InChIInChI=1S/C13H12N2O3/c16-11-3-1-9(2-4-11)6-15-13(18)10-5-12(17)8-14-7-10/h1-5,7-8,16-17H,6H2,(H,15,18)
InChIKeyZRDPKMFVOZPXCT-UHFFFAOYSA-N
MW244.25 g/mol
LogP1.42
Rot. Bonds3

About 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide

5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide (PubChem CID 115621996) has the molecular formula C13H12N2O3 and a molecular weight of 244.25 g/mol. Its IUPAC name is 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide
PubChem CID115621996
Molecular FormulaC13H12N2O3
Molecular Weight244.25 g/mol
Exact Mass244.08
IUPAC Name5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(O)cc1)c1cncc(O)c1
InChIInChI=1S/C13H12N2O3/c16-11-3-1-9(2-4-11)6-15-13(18)10-5-12(17)8-14-7-10/h1-5,7-8,16-17H,6H2,(H,15,18)
InChIKeyZRDPKMFVOZPXCT-UHFFFAOYSA-N
XLogP1.42
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4-(aminomethyl)phenyl]methyl]-5-hydroxypyridine-3-carboxamide
CID 81090318
5-hydroxy-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 63864257
5-(4-hydroxyphenyl)-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 58833166
N-[(3,4-dimethoxyphenyl)methyl]-5-hydroxypyridine-3-carboxamide
CID 63866016
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5-hydroxypyridine-3-carboxamide
CID 63859223
5-hydroxy-N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]pyridine-3-carboxamide
CID 75370768
5-hydroxy-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 63861037
N-[(2-bromophenyl)methyl]-5-hydroxypyridine-3-carboxamide
CID 63852378
N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide
CID 63864753
5-hydroxy-N-[5-[(5-hydroxypyridine-3-carbonyl)amino]pentyl]pyridine-3-carboxamide
CID 3309734
2-[(5-hydroxypyridine-3-carbonyl)amino]acetic acid
CID 770223
5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
CID 55256173

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide (CID 115621996) is 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide is O=C(NCc1ccc(O)cc1)c1cncc(O)c1.
What is the InChIKey of 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide?
The InChIKey is ZRDPKMFVOZPXCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O3/c16-11-3-1-9(2-4-11)6-15-13(18)10-5-12(17)8-14-7-10/h1-5,7-8,16-17H,6H2,(H,15,18).
What are the key properties of 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide?
5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide has a molecular weight of 244.25 g/mol, XLogP of 1.42, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 115621996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).