2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide

C22H17N3O — CID 868286

IUPAC2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)Nc3ccccn3)c3ccccc3n2)cc1
InChIInChI=1S/C22H17N3O/c1-15-9-11-16(12-10-15)20-14-18(17-6-2-3-7-19(17)24-20)22(26)25-21-8-4-5-13-23-21/h2-14H,1H3,(H,23,25,26)
InChIKeyCLPOCHDBIGBOBF-UHFFFAOYSA-N
MW339.40 g/mol
LogP4.86
Rot. Bonds3

About 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide

2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide (PubChem CID 868286) has the molecular formula C22H17N3O and a molecular weight of 339.40 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
PubChem CID868286
Molecular FormulaC22H17N3O
Molecular Weight339.40 g/mol
Exact Mass339.14
IUPAC Name2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
SMILESCc1ccc(-c2cc(C(=O)Nc3ccccn3)c3ccccc3n2)cc1
InChIInChI=1S/C22H17N3O/c1-15-9-11-16(12-10-15)20-14-18(17-6-2-3-7-19(17)24-20)22(26)25-21-8-4-5-13-23-21/h2-14H,1H3,(H,23,25,26)
InChIKeyCLPOCHDBIGBOBF-UHFFFAOYSA-N
XLogP4.86
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
CID 5113014
2-(3-propan-2-yloxyphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
CID 2220820
2-(3-ethoxyphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
CID 1011517
2-(4-methylphenyl)-N-(1,2-oxazol-3-yl)quinoline-4-carboxamide
CID 17285283
2-(3,4-dichlorophenyl)-N-(5-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 3649172
2-(4-methylphenyl)-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide
CID 55810221
N-(4-acetamidophenyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 4863526
2-(4-methylphenyl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 1220288
2-(3-methylphenyl)-N-(5-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 3595937
N-(5-methyl-1H-pyrazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 4793520
2-(3-methylphenyl)-N-(4-methyl-2-pyridinyl)quinoline-4-carboxamide
CID 3663866
6-methyl-N-(4-methyl-2-pyridinyl)-2-phenylquinoline-4-carboxamide
CID 16573417

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide?
The IUPAC name of 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide (CID 868286) is 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide?
The canonical SMILES for 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide is Cc1ccc(-c2cc(C(=O)Nc3ccccn3)c3ccccc3n2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide?
The InChIKey is CLPOCHDBIGBOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O/c1-15-9-11-16(12-10-15)20-14-18(17-6-2-3-7-19(17)24-20)22(26)25-21-8-4-5-13-23-21/h2-14H,1H3,(H,23,25,26).
What are the key properties of 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide?
2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 868286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).