6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide

C10H13ClN2O2 — CID 22336276

IUPAC6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide
SMILESCC(C)(CO)NC(=O)c1cccc(Cl)n1
InChIInChI=1S/C10H13ClN2O2/c1-10(2,6-14)13-9(15)7-4-3-5-8(11)12-7/h3-5,14H,6H2,1-2H3,(H,13,15)
InChIKeyVTBUOIMRFRLRJF-UHFFFAOYSA-N
MW228.68 g/mol
LogP1.24
Rot. Bonds3

About 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide

6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide (PubChem CID 22336276) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide
PubChem CID22336276
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Name6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide
SMILESCC(C)(CO)NC(=O)c1cccc(Cl)n1
InChIInChI=1S/C10H13ClN2O2/c1-10(2,6-14)13-9(15)7-4-3-5-8(11)12-7/h3-5,14H,6H2,1-2H3,(H,13,15)
InChIKeyVTBUOIMRFRLRJF-UHFFFAOYSA-N
XLogP1.24
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-amino-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide
CID 71114856
N-(1-chloro-2-methylpropan-2-yl)-6-methylpyridine-2-carboxamide
CID 114295056
6-chloro-N-[2-(dimethylamino)-2-methylpropyl]pyridine-2-carboxamide
CID 62234225
6-chloro-N-propan-2-ylpyridine-2-carboxamide
CID 24903389
N-(2-acetamidoethyl)-6-chloropyridine-2-carboxamide
CID 62234709
6-chloro-N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 62239936
6-chloro-N-(2-ethyl-2-hydroxybutyl)pyridine-2-carboxamide
CID 65107379
6-chloro-N-(5-hydroxypentyl)pyridine-2-carboxamide
CID 107317157
6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide
CID 22336258
2-[[(6-chloropyridine-2-carbonyl)amino]methyl]-2-ethylbutanoic acid
CID 113308451
6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-2-carboxamide
CID 62238570
6-chloro-N-(2,3-dimethylbutyl)pyridine-2-carboxamide
CID 64570115

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide (CID 22336276) is 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide is CC(C)(CO)NC(=O)c1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide?
The InChIKey is VTBUOIMRFRLRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c1-10(2,6-14)13-9(15)7-4-3-5-8(11)12-7/h3-5,14H,6H2,1-2H3,(H,13,15).
What are the key properties of 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide?
6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide has a molecular weight of 228.68 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 22336276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).