2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide

C23H20N4O2 — CID 126458298

IUPAC2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
SMILESCOc1ccc(Nc2cc(C(=O)NCc3ccccn3)c3ccccc3n2)cc1
InChIInChI=1S/C23H20N4O2/c1-29-18-11-9-16(10-12-18)26-22-14-20(19-7-2-3-8-21(19)27-22)23(28)25-15-17-6-4-5-13-24-17/h2-14H,15H2,1H3,(H,25,28)(H,26,27)
InChIKeyNIURTNCQTMQHAU-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.31
Rot. Bonds6

About 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide

2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide (PubChem CID 126458298) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
PubChem CID126458298
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
SMILESCOc1ccc(Nc2cc(C(=O)NCc3ccccn3)c3ccccc3n2)cc1
InChIInChI=1S/C23H20N4O2/c1-29-18-11-9-16(10-12-18)26-22-14-20(19-7-2-3-8-21(19)27-22)23(28)25-15-17-6-4-5-13-24-17/h2-14H,15H2,1H3,(H,25,28)(H,26,27)
InChIKeyNIURTNCQTMQHAU-UHFFFAOYSA-N
XLogP4.31
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-chlorophenyl)methyl]-2-(4-methoxyanilino)quinoline-4-carboxamide
CID 20854379
2-(2-methylanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 15994894
N-(2,2-dimethoxyethyl)-2-(4-methoxyanilino)quinoline-4-carboxamide
CID 46253310
2-(2-methoxyphenyl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 4225926
2-(4-methoxyanilino)-N-[2-(4-methylphenyl)ethyl]quinoline-4-carboxamide
CID 20854390
N'-(2-chloroacetyl)-2-(4-methoxyanilino)quinoline-4-carbohydrazide
CID 14892420
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methoxyanilino)quinoline-4-carboxamide
CID 20854384
2-phenyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 757671
5-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 109234998
2-(4-methylphenyl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 1220288
2-(4-methoxyanilino)-N-(3-morpholin-4-ylpropyl)quinoline-4-carboxamide
CID 24793582
(3S)-3-(4-methoxyphenyl)-3-phenyl-N-(pyridin-2-ylmethyl)propanamide
CID 26404777

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide?
The IUPAC name of 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide (CID 126458298) is 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide?
The canonical SMILES for 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide is COc1ccc(Nc2cc(C(=O)NCc3ccccn3)c3ccccc3n2)cc1.
What is the InChIKey of 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide?
The InChIKey is NIURTNCQTMQHAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-29-18-11-9-16(10-12-18)26-22-14-20(19-7-2-3-8-21(19)27-22)23(28)25-15-17-6-4-5-13-24-17/h2-14H,15H2,1H3,(H,25,28)(H,26,27).
What are the key properties of 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide?
2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 4.31, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyanilino)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide is sourced from PubChem (CID 126458298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).