3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide

C10H14N2O3 — CID 142553714

IUPAC3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NC(C)C)c1O
InChIInChI=1S/C10H14N2O3/c1-6(2)12-10(14)8-9(13)7(15-3)4-5-11-8/h4-6,13H,1-3H3,(H,12,14)
InChIKeyGOIWWDWFHYPNNQ-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.93
Rot. Bonds3

About 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide

3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide (PubChem CID 142553714) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide
PubChem CID142553714
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NC(C)C)c1O
InChIInChI=1S/C10H14N2O3/c1-6(2)12-10(14)8-9(13)7(15-3)4-5-11-8/h4-6,13H,1-3H3,(H,12,14)
InChIKeyGOIWWDWFHYPNNQ-UHFFFAOYSA-N
XLogP0.93
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-4-methoxy-N-[(2S)-3-oxobutan-2-yl]pyridine-2-carboxamide
CID 163574923
3-hydroxy-4-methoxy-N-(1-oxopropan-2-yl)pyridine-2-carboxamide
CID 138538614
3-hydroxy-4-methoxy-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide
CID 142046009
N-cyclobutyl-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 21088893
N-cyclohexyl-3-hydroxy-4-methoxypyridine-2-carboxamide
CID 21088897
[(2S)-1-(2-methylpropoxy)propan-2-yl] (2S)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate
CID 121466267
[(2S)-4-methylpent-4-en-2-yl] (2S)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate
CID 145115451
[(2S)-1-phenylpropan-2-yl] (2S)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate
CID 146589882
[(2R,3R)-3-(4-fluorophenyl)butan-2-yl] (2R)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate
CID 139472781
1-cyclohexylpropyl (2S)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate
CID 165176388
1-(3-hydroxy-4-methoxy-2-pyridinyl)-2-methylbutan-1-one
CID 126489558
[(1S,2S)-1-methoxy-1-phenylpropan-2-yl] (2S)-2-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]propanoate
CID 121462029

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide?
The IUPAC name of 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide (CID 142553714) is 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide.
What is the SMILES notation for 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide?
The canonical SMILES for 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide is COc1ccnc(C(=O)NC(C)C)c1O.
What is the InChIKey of 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide?
The InChIKey is GOIWWDWFHYPNNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6(2)12-10(14)8-9(13)7(15-3)4-5-11-8/h4-6,13H,1-3H3,(H,12,14).
What are the key properties of 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide?
3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide has a molecular weight of 210.23 g/mol, XLogP of 0.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-methoxy-N-propan-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 142553714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).