N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide

C23H25N3O2 — CID 109220430

IUPACN-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2cc(Nc3ccccc3C(C)C)ccn2)cc1
InChIInChI=1S/C23H25N3O2/c1-4-28-19-11-9-17(10-12-19)26-23(27)22-15-18(13-14-24-22)25-21-8-6-5-7-20(21)16(2)3/h5-16H,4H2,1-3H3,(H,24,25)(H,26,27)
InChIKeyBPPYFZSDVJQRGY-UHFFFAOYSA-N
MW375.47 g/mol
LogP5.60
Rot. Bonds7

About N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide

N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide (PubChem CID 109220430) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide
PubChem CID109220430
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2cc(Nc3ccccc3C(C)C)ccn2)cc1
InChIInChI=1S/C23H25N3O2/c1-4-28-19-11-9-17(10-12-19)26-23(27)22-15-18(13-14-24-22)25-21-8-6-5-7-20(21)16(2)3/h5-16H,4H2,1-3H3,(H,24,25)(H,26,27)
InChIKeyBPPYFZSDVJQRGY-UHFFFAOYSA-N
XLogP5.60
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.47
LogP ≤ 55.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetamidophenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109220437
N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109220864
N-(4-ethoxyphenyl)-4-(1-phenylethylamino)pyridine-2-carboxamide
CID 109210831
4-(2,4-dimethylanilino)-N-(4-ethoxyphenyl)pyridine-2-carboxamide
CID 109219771
4-(3,4-dimethylanilino)-N-(4-ethoxyphenyl)pyridine-2-carboxamide
CID 109219903
N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109221025
4-(2-propan-2-ylanilino)-N-prop-2-enylpyridine-2-carboxamide
CID 109202178
4-(2-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109219027
4-(2-ethoxyanilino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109219228
6-(4-ethoxyanilino)-N-(2-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 109357593
N-(3-methylbutyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109217303
N-(2-propan-2-ylphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201226

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide (CID 109220430) is N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide is CCOc1ccc(NC(=O)c2cc(Nc3ccccc3C(C)C)ccn2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide?
The InChIKey is BPPYFZSDVJQRGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-4-28-19-11-9-17(10-12-19)26-23(27)22-15-18(13-14-24-22)25-21-8-6-5-7-20(21)16(2)3/h5-16H,4H2,1-3H3,(H,24,25)(H,26,27).
What are the key properties of N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide?
N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 5.60, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109220430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).