N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide

C24H21N3O2 — CID 3682103

IUPACN-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide
SMILESCc1ccccc1N(Cc1cc2cccc(C)c2[nH]c1=O)C(=O)c1ccncc1
InChIInChI=1S/C24H21N3O2/c1-16-6-3-4-9-21(16)27(24(29)18-10-12-25-13-11-18)15-20-14-19-8-5-7-17(2)22(19)26-23(20)28/h3-14H,15H2,1-2H3,(H,26,28)
InChIKeyZQCCZAASMHKQIL-UHFFFAOYSA-N
MW383.45 g/mol
LogP4.39
Rot. Bonds4

About N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide

N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide (PubChem CID 3682103) has the molecular formula C24H21N3O2 and a molecular weight of 383.45 g/mol. Its IUPAC name is N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide
PubChem CID3682103
Molecular FormulaC24H21N3O2
Molecular Weight383.45 g/mol
Exact Mass383.16
IUPAC NameN-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide
SMILESCc1ccccc1N(Cc1cc2cccc(C)c2[nH]c1=O)C(=O)c1ccncc1
InChIInChI=1S/C24H21N3O2/c1-16-6-3-4-9-21(16)27(24(29)18-10-12-25-13-11-18)15-20-14-19-8-5-7-17(2)22(19)26-23(20)28/h3-14H,15H2,1-2H3,(H,26,28)
InChIKeyZQCCZAASMHKQIL-UHFFFAOYSA-N
XLogP4.39
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide (CID 3682103) is N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide is Cc1ccccc1N(Cc1cc2cccc(C)c2[nH]c1=O)C(=O)c1ccncc1.
What is the InChIKey of N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide?
The InChIKey is ZQCCZAASMHKQIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O2/c1-16-6-3-4-9-21(16)27(24(29)18-10-12-25-13-11-18)15-20-14-19-8-5-7-17(2)22(19)26-23(20)28/h3-14H,15H2,1-2H3,(H,26,28).
What are the key properties of N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide?
N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 3682103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).