2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide

C11H14N2O5 — CID 106102857

IUPAC2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide
SMILESO=C(NCC1(O)CCOC1)c1cc(O)[nH]c(=O)c1
InChIInChI=1S/C11H14N2O5/c14-8-3-7(4-9(15)13-8)10(16)12-5-11(17)1-2-18-6-11/h3-4,17H,1-2,5-6H2,(H,12,16)(H2,13,14,15)
InChIKeyLWZDHKKLGYHGIA-UHFFFAOYSA-N
MW254.24 g/mol
LogP-1.04
Rot. Bonds3

About 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide

2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 106102857) has the molecular formula C11H14N2O5 and a molecular weight of 254.24 g/mol. Its IUPAC name is 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide
PubChem CID106102857
Molecular FormulaC11H14N2O5
Molecular Weight254.24 g/mol
Exact Mass254.09
IUPAC Name2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide
SMILESO=C(NCC1(O)CCOC1)c1cc(O)[nH]c(=O)c1
InChIInChI=1S/C11H14N2O5/c14-8-3-7(4-9(15)13-8)10(16)12-5-11(17)1-2-18-6-11/h3-4,17H,1-2,5-6H2,(H,12,16)(H2,13,14,15)
InChIKeyLWZDHKKLGYHGIA-UHFFFAOYSA-N
XLogP-1.04
TPSA111.65 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 5-1.04
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

1-[[(2-hydroxy-6-oxo-1H-pyridine-4-carbonyl)amino]methyl]cyclopropane-1-carboxylic acid
CID 113311941
2-hydroxy-N-[(1-hydroxy-3-methylcyclohexyl)methyl]-6-oxo-1H-pyridine-4-carboxamide
CID 65123700
3-amino-5-chloro-N-[(3-hydroxyoxolan-3-yl)methyl]benzamide
CID 106099030
5-bromo-N-[(3-hydroxyoxolan-3-yl)methyl]furan-3-carboxamide
CID 84590622
N-[(3-hydroxyoxolan-3-yl)methyl]naphthalene-2-carboxamide
CID 103848682
N-[(3-hydroxyoxolan-3-yl)methyl]furan-3-carboxamide
CID 103848998
N-[(3-hydroxyoxolan-3-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 103849205
3-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-4-methoxybenzamide
CID 103849817
3-chloro-N-[[(3S)-3-hydroxyoxolan-3-yl]methyl]-5-(trifluoromethyl)benzamide
CID 129399312
4-cyano-N-[(3-hydroxyoxolan-3-yl)methyl]benzamide
CID 113338032
3-bromo-N-[(3-hydroxyoxolan-3-yl)methyl]-4-methylbenzamide
CID 103849475
4-amino-3-fluoro-N-[(3-hydroxyoxolan-3-yl)methyl]benzamide
CID 106099036

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide (CID 106102857) is 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide is O=C(NCC1(O)CCOC1)c1cc(O)[nH]c(=O)c1.
What is the InChIKey of 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is LWZDHKKLGYHGIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O5/c14-8-3-7(4-9(15)13-8)10(16)12-5-11(17)1-2-18-6-11/h3-4,17H,1-2,5-6H2,(H,12,16)(H2,13,14,15).
What are the key properties of 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide?
2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 254.24 g/mol, XLogP of -1.04, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(3-hydroxyoxolan-3-yl)methyl]-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 106102857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).