4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide

C24H23N3O2 — CID 109091643

IUPAC4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide
SMILESCCc1ccc(NC(=O)c2cc(C(=O)N3CCCc4ccccc43)ccn2)cc1
InChIInChI=1S/C24H23N3O2/c1-2-17-9-11-20(12-10-17)26-23(28)21-16-19(13-14-25-21)24(29)27-15-5-7-18-6-3-4-8-22(18)27/h3-4,6,8-14,16H,2,5,7,15H2,1H3,(H,26,28)
InChIKeyNQFSAEDWZNPJEX-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.49
Rot. Bonds4

About 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide

4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide (PubChem CID 109091643) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide
PubChem CID109091643
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC Name4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide
SMILESCCc1ccc(NC(=O)c2cc(C(=O)N3CCCc4ccccc43)ccn2)cc1
InChIInChI=1S/C24H23N3O2/c1-2-17-9-11-20(12-10-17)26-23(28)21-16-19(13-14-25-21)24(29)27-15-5-7-18-6-3-4-8-22(18)27/h3-4,6,8-14,16H,2,5,7,15H2,1H3,(H,26,28)
InChIKeyNQFSAEDWZNPJEX-UHFFFAOYSA-N
XLogP4.49
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide (CID 109091643) is 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide is CCc1ccc(NC(=O)c2cc(C(=O)N3CCCc4ccccc43)ccn2)cc1.
What is the InChIKey of 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide?
The InChIKey is NQFSAEDWZNPJEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-2-17-9-11-20(12-10-17)26-23(28)21-16-19(13-14-25-21)24(29)27-15-5-7-18-6-3-4-8-22(18)27/h3-4,6,8-14,16H,2,5,7,15H2,1H3,(H,26,28).
What are the key properties of 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide?
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide has a molecular weight of 385.47 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109091643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).