2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide

C8H10N2O4 — CID 137180931

IUPAC2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1cc(CCO)c(=O)[nH]c1O
InChIInChI=1S/C8H10N2O4/c9-6(12)5-3-4(1-2-11)7(13)10-8(5)14/h3,11H,1-2H2,(H2,9,12)(H2,10,13,14)
InChIKeyBPFAEFODIJDJQD-UHFFFAOYSA-N
MW198.18 g/mol
LogP-1.29
Rot. Bonds3

About 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide

2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 137180931) has the molecular formula C8H10N2O4 and a molecular weight of 198.18 g/mol. Its IUPAC name is 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID137180931
Molecular FormulaC8H10N2O4
Molecular Weight198.18 g/mol
Exact Mass198.06
IUPAC Name2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESNC(=O)c1cc(CCO)c(=O)[nH]c1O
InChIInChI=1S/C8H10N2O4/c9-6(12)5-3-4(1-2-11)7(13)10-8(5)14/h3,11H,1-2H2,(H2,9,12)(H2,10,13,14)
InChIKeyBPFAEFODIJDJQD-UHFFFAOYSA-N
XLogP-1.29
TPSA116.41 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.18
LogP ≤ 5-1.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-hydroxyethyl)-6-iodo-1H-pyridin-2-one
CID 170115876

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide (CID 137180931) is 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide is NC(=O)c1cc(CCO)c(=O)[nH]c1O.
What is the InChIKey of 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is BPFAEFODIJDJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O4/c9-6(12)5-3-4(1-2-11)7(13)10-8(5)14/h3,11H,1-2H2,(H2,9,12)(H2,10,13,14).
What are the key properties of 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide?
2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 198.18 g/mol, XLogP of -1.29, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 137180931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).