3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide

C11H16N2O2 — CID 81443662

IUPAC3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide
SMILESCCC(C)(C)NC(=O)c1ccncc1O
InChIInChI=1S/C11H16N2O2/c1-4-11(2,3)13-10(15)8-5-6-12-7-9(8)14/h5-7,14H,4H2,1-3H3,(H,13,15)
InChIKeySAMPVWJBWDYEFZ-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.71
Rot. Bonds3

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

3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide (PubChem CID 81443662) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide
PubChem CID81443662
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide
SMILESCCC(C)(C)NC(=O)c1ccncc1O
InChIInChI=1S/C11H16N2O2/c1-4-11(2,3)13-10(15)8-5-6-12-7-9(8)14/h5-7,14H,4H2,1-3H3,(H,13,15)
InChIKeySAMPVWJBWDYEFZ-UHFFFAOYSA-N
XLogP1.71
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyanopentan-3-yl)-3-hydroxypyridine-4-carboxamide
CID 81445991
3-[4-(2-methylbutan-2-ylcarbamoyl)-3-pyridinyl]prop-2-enoic acid
CID 77135282
tris(3-hydroxy-N-methylpyridine-4-carboxamide);iron
CID 163419095
N-[2-(aminomethyl)-2-ethylbutyl]-3-hydroxypyridine-4-carboxamide
CID 114164077
3-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-4-carboxamide
CID 66481995
N-(2,2-difluoro-3-hydroxypropyl)-3-hydroxypyridine-4-carboxamide
CID 104864896
(2R)-2-[(3-hydroxypyridine-4-carbonyl)amino]butanoic acid
CID 81445874
N-(2-amino-3-ethylpentyl)-3-hydroxypyridine-4-carboxamide
CID 106286387
3-amino-N-(3-ethylpentan-3-yl)pyridine-4-carboxamide
CID 105070428
4-chloro-N-(3-methylpentan-3-yl)pyridine-3-carboxamide
CID 103875358
3-hydroxy-N-(2-methylbutan-2-yl)naphthalene-2-carboxamide
CID 43403898
3-hydroxy-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)pyridine-4-carboxamide
CID 113257057

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide (CID 81443662) is 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide is CCC(C)(C)NC(=O)c1ccncc1O.
What is the InChIKey of 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide?
The InChIKey is SAMPVWJBWDYEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-4-11(2,3)13-10(15)8-5-6-12-7-9(8)14/h5-7,14H,4H2,1-3H3,(H,13,15).
What are the key properties of 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide?
3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 1.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-methylbutan-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 81443662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).