6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide

C16H19N3O — CID 62239244

IUPAC6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide
SMILESCC(C)(C)c1ccc(NC(=O)c2cccc(N)n2)cc1
InChIInChI=1S/C16H19N3O/c1-16(2,3)11-7-9-12(10-8-11)18-15(20)13-5-4-6-14(17)19-13/h4-10H,1-3H3,(H2,17,19)(H,18,20)
InChIKeyZWSJXPIFPOJCES-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.21
Rot. Bonds2

About 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide

6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide (PubChem CID 62239244) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide
PubChem CID62239244
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide
SMILESCC(C)(C)c1ccc(NC(=O)c2cccc(N)n2)cc1
InChIInChI=1S/C16H19N3O/c1-16(2,3)11-7-9-12(10-8-11)18-15(20)13-5-4-6-14(17)19-13/h4-10H,1-3H3,(H2,17,19)(H,18,20)
InChIKeyZWSJXPIFPOJCES-UHFFFAOYSA-N
XLogP3.21
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-tert-butylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62239245
6-amino-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 62239989
6-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxamide
CID 62239251
6-amino-N-[3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 62238899
6-N-butyl-2-N-(4-tert-butylphenyl)-6-N-methylpyridine-2,6-dicarboxamide
CID 109099555
5-[(4-tert-butylphenyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120684723
N-(4-aminophenyl)-6-methylpyridine-2-carboxamide
CID 16784436
6-amino-N-(1,2-oxazol-4-yl)pyridine-2-carboxamide
CID 62914715
6-amino-N-[4-bromo-3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 64854382
6-amino-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-2-carboxamide
CID 71114856
N-(4-tert-butylphenyl)-1-methyltriazole-4-carboxamide
CID 110439460
6-amino-N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide
CID 62239085

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide (CID 62239244) is 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide is CC(C)(C)c1ccc(NC(=O)c2cccc(N)n2)cc1.
What is the InChIKey of 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide?
The InChIKey is ZWSJXPIFPOJCES-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-16(2,3)11-7-9-12(10-8-11)18-15(20)13-5-4-6-14(17)19-13/h4-10H,1-3H3,(H2,17,19)(H,18,20).
What are the key properties of 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide?
6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 3.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(4-tert-butylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62239244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).