2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide

C21H21N3O2 — CID 46283332

IUPAC2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
SMILESCCc1cccc(Nc2cc(C(=O)Nc3ccc(OC)cc3)ccn2)c1
InChIInChI=1S/C21H21N3O2/c1-3-15-5-4-6-18(13-15)23-20-14-16(11-12-22-20)21(25)24-17-7-9-19(26-2)10-8-17/h4-14H,3H2,1-2H3,(H,22,23)(H,24,25)
InChIKeyYTFXOAGEPBXUKG-UHFFFAOYSA-N
MW347.42 g/mol
LogP4.65
Rot. Bonds6

About 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide

2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide (PubChem CID 46283332) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
PubChem CID46283332
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
SMILESCCc1cccc(Nc2cc(C(=O)Nc3ccc(OC)cc3)ccn2)c1
InChIInChI=1S/C21H21N3O2/c1-3-15-5-4-6-18(13-15)23-20-14-16(11-12-22-20)21(25)24-17-7-9-19(26-2)10-8-17/h4-14H,3H2,1-2H3,(H,22,23)(H,24,25)
InChIKeyYTFXOAGEPBXUKG-UHFFFAOYSA-N
XLogP4.65
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-acetamidoanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109178041
ethyl 4-[[2-(3-methoxyanilino)pyridine-4-carbonyl]amino]benzoate
CID 109178018
ethyl 4-[[4-[(4-methoxyphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 46283329
2-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109178053
2-(4-ethoxyanilino)-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109177953
2-(3,4-dimethoxyanilino)-N-(4-ethoxyphenyl)pyridine-4-carboxamide
CID 109178168
2-(3-chloro-4-fluoroanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 46283339
2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 46283333
N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
CID 109176999
2-(3-chloroanilino)-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109177464
2-(3-bromoanilino)-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109177974
N-(3-bromophenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
CID 109178014

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide (CID 46283332) is 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide is CCc1cccc(Nc2cc(C(=O)Nc3ccc(OC)cc3)ccn2)c1.
What is the InChIKey of 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide?
The InChIKey is YTFXOAGEPBXUKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2/c1-3-15-5-4-6-18(13-15)23-20-14-16(11-12-22-20)21(25)24-17-7-9-19(26-2)10-8-17/h4-14H,3H2,1-2H3,(H,22,23)(H,24,25).
What are the key properties of 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide?
2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 4.65, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 46283332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).