N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide

C20H18ClN3O2 — CID 109221025

IUPACN-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccnc(C(=O)Nc2ccc(Cl)cc2)c1
InChIInChI=1S/C20H18ClN3O2/c1-2-26-19-6-4-3-5-17(19)23-16-11-12-22-18(13-16)20(25)24-15-9-7-14(21)8-10-15/h3-13H,2H2,1H3,(H,22,23)(H,24,25)
InChIKeyOLKOFTKACVNEQV-UHFFFAOYSA-N
MW367.84 g/mol
LogP5.13
Rot. Bonds6

About N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide

N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide (PubChem CID 109221025) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
PubChem CID109221025
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC NameN-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccnc(C(=O)Nc2ccc(Cl)cc2)c1
InChIInChI=1S/C20H18ClN3O2/c1-2-26-19-6-4-3-5-17(19)23-16-11-12-22-18(13-16)20(25)24-15-9-7-14(21)8-10-15/h3-13H,2H2,1H3,(H,22,23)(H,24,25)
InChIKeyOLKOFTKACVNEQV-UHFFFAOYSA-N
XLogP5.13
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.84
LogP ≤ 55.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-ethoxyanilino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109219228
N-(3,5-dimethylphenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109219935
4-(2-ethoxyanilino)-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109219092
methyl 2-[[2-[(4-chlorophenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109221037
N-[2-(3-chlorophenyl)ethyl]-4-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109218485
N-(4-ethoxyphenyl)-4-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109220430
4-(2-ethoxyanilino)-N-(3-methylbutyl)pyridine-2-carboxamide
CID 109217325
N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201237
2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090848
4-chloro-N-[5-(2-ethoxyanilino)-2-pyridinyl]benzamide
CID 113034282
N-(4-chloro-2-methylphenyl)-4-(2-methoxyanilino)pyridine-2-carboxamide
CID 109221193
[4-(2-ethoxyanilino)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203739

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide (CID 109221025) is N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide is CCOc1ccccc1Nc1ccnc(C(=O)Nc2ccc(Cl)cc2)c1.
What is the InChIKey of N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide?
The InChIKey is OLKOFTKACVNEQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-2-26-19-6-4-3-5-17(19)23-16-11-12-22-18(13-16)20(25)24-15-9-7-14(21)8-10-15/h3-13H,2H2,1H3,(H,22,23)(H,24,25).
What are the key properties of N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide?
N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide has a molecular weight of 367.84 g/mol, XLogP of 5.13, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-4-(2-ethoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109221025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).