2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide

C10H14N2O4 — CID 104981474

IUPAC2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide
SMILESCC[C@@H](CO)NC(=O)c1cc(O)[nH]c(=O)c1
InChIInChI=1S/C10H14N2O4/c1-2-7(5-13)11-10(16)6-3-8(14)12-9(15)4-6/h3-4,7,13H,2,5H2,1H3,(H,11,16)(H2,12,14,15)/t7-/m0/s1
InChIKeyOJUSYEDJOLMLSE-ZETCQYMHSA-N
MW226.23 g/mol
LogP-0.42
Rot. Bonds4

About 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide

2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 104981474) has the molecular formula C10H14N2O4 and a molecular weight of 226.23 g/mol. Its IUPAC name is 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide
PubChem CID104981474
Molecular FormulaC10H14N2O4
Molecular Weight226.23 g/mol
Exact Mass226.10
IUPAC Name2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide
SMILESCC[C@@H](CO)NC(=O)c1cc(O)[nH]c(=O)c1
InChIInChI=1S/C10H14N2O4/c1-2-7(5-13)11-10(16)6-3-8(14)12-9(15)4-6/h3-4,7,13H,2,5H2,1H3,(H,11,16)(H2,12,14,15)/t7-/m0/s1
InChIKeyOJUSYEDJOLMLSE-ZETCQYMHSA-N
XLogP-0.42
TPSA102.42 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.23
LogP ≤ 5-0.42
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide (CID 104981474) is 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide is CC[C@@H](CO)NC(=O)c1cc(O)[nH]c(=O)c1.
What is the InChIKey of 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is OJUSYEDJOLMLSE-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H14N2O4/c1-2-7(5-13)11-10(16)6-3-8(14)12-9(15)4-6/h3-4,7,13H,2,5H2,1H3,(H,11,16)(H2,12,14,15)/t7-/m0/s1.
What are the key properties of 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide?
2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 226.23 g/mol, XLogP of -0.42, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(2S)-1-hydroxybutan-2-yl]-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 104981474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).