5-(tert-butylamino)-N-phenylpyridine-3-carboxamide

C16H19N3O — CID 109239388

IUPAC5-(tert-butylamino)-N-phenylpyridine-3-carboxamide
SMILESCC(C)(C)Nc1cncc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C16H19N3O/c1-16(2,3)19-14-9-12(10-17-11-14)15(20)18-13-7-5-4-6-8-13/h4-11,19H,1-3H3,(H,18,20)
InChIKeyQZTDJSDCJOZDJO-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.54
Rot. Bonds3

About 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide

5-(tert-butylamino)-N-phenylpyridine-3-carboxamide (PubChem CID 109239388) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(tert-butylamino)-N-phenylpyridine-3-carboxamide
PubChem CID109239388
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name5-(tert-butylamino)-N-phenylpyridine-3-carboxamide
SMILESCC(C)(C)Nc1cncc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C16H19N3O/c1-16(2,3)19-14-9-12(10-17-11-14)15(20)18-13-7-5-4-6-8-13/h4-11,19H,1-3H3,(H,18,20)
InChIKeyQZTDJSDCJOZDJO-UHFFFAOYSA-N
XLogP3.54
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-5-(tert-butylamino)pyridine-3-carboxamide
CID 109239462
N-(4-acetylphenyl)-5-(tert-butylamino)pyridine-3-carboxamide
CID 109239442
N-(4-bromophenyl)-5-(tert-butylamino)pyridine-3-carboxamide
CID 109239425
5-N-tert-butyl-3-N-phenylpyridine-3,5-dicarboxamide
CID 109106910
5-(tert-butylamino)-N-(2-tert-butylphenyl)pyridine-3-carboxamide
CID 109239410
5-(tert-butylamino)-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide
CID 109239451
5-(tert-butylamino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide
CID 109239408
5-(tert-butylamino)-N-(2,3-dimethylphenyl)pyridine-3-carboxamide
CID 109239400
N-(4-bromo-3-methylphenyl)-5-(tert-butylamino)pyridine-3-carboxamide
CID 109239465
5-(tert-butylamino)-N-(2,5-dimethylphenyl)pyridine-3-carboxamide
CID 109239396
5-(tert-butylamino)-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 109239395
5-[(4-methylphenyl)methylamino]-N-phenylpyridine-3-carboxamide
CID 109232664

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide?
The IUPAC name of 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide (CID 109239388) is 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide?
The canonical SMILES for 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide is CC(C)(C)Nc1cncc(C(=O)Nc2ccccc2)c1.
What is the InChIKey of 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide?
The InChIKey is QZTDJSDCJOZDJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-16(2,3)19-14-9-12(10-17-11-14)15(20)18-13-7-5-4-6-8-13/h4-11,19H,1-3H3,(H,18,20).
What are the key properties of 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide?
5-(tert-butylamino)-N-phenylpyridine-3-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylamino)-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 109239388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).