2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide

C22H18N4O — CID 109176218

IUPAC2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide
SMILESCc1ccccc1Nc1cc(C(=O)Nc2cccc3cccnc23)ccn1
InChIInChI=1S/C22H18N4O/c1-15-6-2-3-9-18(15)25-20-14-17(11-13-23-20)22(27)26-19-10-4-7-16-8-5-12-24-21(16)19/h2-14H,1H3,(H,23,25)(H,26,27)
InChIKeyFHSZYRFJBYZBNI-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.93
Rot. Bonds4

About 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide

2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide (PubChem CID 109176218) has the molecular formula C22H18N4O and a molecular weight of 354.41 g/mol. Its IUPAC name is 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide
PubChem CID109176218
Molecular FormulaC22H18N4O
Molecular Weight354.41 g/mol
Exact Mass354.15
IUPAC Name2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide
SMILESCc1ccccc1Nc1cc(C(=O)Nc2cccc3cccnc23)ccn1
InChIInChI=1S/C22H18N4O/c1-15-6-2-3-9-18(15)25-20-14-17(11-13-23-20)22(27)26-19-10-4-7-16-8-5-12-24-21(16)19/h2-14H,1H3,(H,23,25)(H,26,27)
InChIKeyFHSZYRFJBYZBNI-UHFFFAOYSA-N
XLogP4.93
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-methylanilino)-N-quinolin-8-ylpyridine-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

2-hydrazinyl-N-quinolin-8-ylpyridine-4-carboxamide
CID 62235936
2-(4-methoxyanilino)-N-quinolin-8-ylpyridine-4-carboxamide
CID 109178089
N-(3-chloro-4-methylphenyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide
CID 109177701
2-(methylamino)-N-(2-methylphenyl)pyridine-4-carboxamide
CID 55042330
6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109334786
2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109093313
N-(2,5-dimethylphenyl)-6-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109162626
2-(3-phenylpropylamino)-N-quinolin-8-ylpyridine-4-carboxamide
CID 109174892
2-(3-bromoanilino)-N-(2-methylphenyl)pyridine-4-carboxamide
CID 109176186
N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide
CID 109172233
5-methyl-N-quinolin-8-ylthiophene-3-carboxamide
CID 166451949
N-[4-(diethylamino)phenyl]-2-(2-methylanilino)pyridine-4-carboxamide
CID 109176212

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide?
The IUPAC name of 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide (CID 109176218) is 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide.
What is the SMILES notation for 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide?
The canonical SMILES for 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide is Cc1ccccc1Nc1cc(C(=O)Nc2cccc3cccnc23)ccn1.
What is the InChIKey of 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide?
The InChIKey is FHSZYRFJBYZBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O/c1-15-6-2-3-9-18(15)25-20-14-17(11-13-23-20)22(27)26-19-10-4-7-16-8-5-12-24-21(16)19/h2-14H,1H3,(H,23,25)(H,26,27).
What are the key properties of 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide?
2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide has a molecular weight of 354.41 g/mol, XLogP of 4.93, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide is sourced from PubChem (CID 109176218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).