5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide

C10H14N2O3 — CID 115283714

IUPAC5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide
SMILESCC(CCO)NC(=O)c1cncc(O)c1
InChIInChI=1S/C10H14N2O3/c1-7(2-3-13)12-10(15)8-4-9(14)6-11-5-8/h4-7,13-14H,2-3H2,1H3,(H,12,15)
InChIKeyXBZYWCSQUHKETH-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.29
Rot. Bonds4

About 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide

5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide (PubChem CID 115283714) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide
PubChem CID115283714
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide
SMILESCC(CCO)NC(=O)c1cncc(O)c1
InChIInChI=1S/C10H14N2O3/c1-7(2-3-13)12-10(15)8-4-9(14)6-11-5-8/h4-7,13-14H,2-3H2,1H3,(H,12,15)
InChIKeyXBZYWCSQUHKETH-UHFFFAOYSA-N
XLogP0.29
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide?
The IUPAC name of 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide (CID 115283714) is 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide is CC(CCO)NC(=O)c1cncc(O)c1.
What is the InChIKey of 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide?
The InChIKey is XBZYWCSQUHKETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-7(2-3-13)12-10(15)8-4-9(14)6-11-5-8/h4-7,13-14H,2-3H2,1H3,(H,12,15).
What are the key properties of 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide?
5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide has a molecular weight of 210.23 g/mol, XLogP of 0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 115283714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).