5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide

C12H12N2O3 — CID 55256173

IUPAC5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
SMILESCc1ccc(CNC(=O)c2cncc(O)c2)o1
InChIInChI=1S/C12H12N2O3/c1-8-2-3-11(17-8)7-14-12(16)9-4-10(15)6-13-5-9/h2-6,15H,7H2,1H3,(H,14,16)
InChIKeyNDXKTQYMOAHHFM-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.62
Rot. Bonds3

About 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide

5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 55256173) has the molecular formula C12H12N2O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
PubChem CID55256173
Molecular FormulaC12H12N2O3
Molecular Weight232.24 g/mol
Exact Mass232.08
IUPAC Name5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
SMILESCc1ccc(CNC(=O)c2cncc(O)c2)o1
InChIInChI=1S/C12H12N2O3/c1-8-2-3-11(17-8)7-14-12(16)9-4-10(15)6-13-5-9/h2-6,15H,7H2,1H3,(H,14,16)
InChIKeyNDXKTQYMOAHHFM-UHFFFAOYSA-N
XLogP1.62
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)-5-hydroxypyridine-3-carboxamide
CID 63864753
5-hydroxy-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide
CID 55258652
3,4-dichloro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731633
5-hydroxy-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-ylpyridine-3-carboxamide
CID 63859047
3,3-dimethyl-N-[(5-methylfuran-2-yl)methyl]-2-oxo-1H-pyrrolo[3,2-b]pyridine-6-carboxamide
CID 142502452
5-hydroxy-N-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide
CID 115621996
N-[(4,5-dimethylthiophen-2-yl)methyl]-5-hydroxypyridine-3-carboxamide
CID 65244137
5-hydroxy-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 63864257
4-chloro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731652
6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
CID 62523594
3-fluoro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731628
4-fluoro-3-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 63213507

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide (CID 55256173) is 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide is Cc1ccc(CNC(=O)c2cncc(O)c2)o1.
What is the InChIKey of 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is NDXKTQYMOAHHFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3/c1-8-2-3-11(17-8)7-14-12(16)9-4-10(15)6-13-5-9/h2-6,15H,7H2,1H3,(H,14,16).
What are the key properties of 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide?
5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 232.24 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 55256173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).