3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide

C24H22N2O3 — CID 109057134

IUPAC3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cccc(C(=O)N3CCCc4ccccc43)c2)cc1
InChIInChI=1S/C24H22N2O3/c1-29-21-13-11-20(12-14-21)25-23(27)18-7-4-8-19(16-18)24(28)26-15-5-9-17-6-2-3-10-22(17)26/h2-4,6-8,10-14,16H,5,9,15H2,1H3,(H,25,27)
InChIKeyGFBSWCVJMYUNPX-UHFFFAOYSA-N
MW386.45 g/mol
LogP4.54
Rot. Bonds4

About 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide

3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide (PubChem CID 109057134) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide.

Molecular Properties

Compound Name3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide
PubChem CID109057134
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2cccc(C(=O)N3CCCc4ccccc43)c2)cc1
InChIInChI=1S/C24H22N2O3/c1-29-21-13-11-20(12-14-21)25-23(27)18-7-4-8-19(16-18)24(28)26-15-5-9-17-6-2-3-10-22(17)26/h2-4,6-8,10-14,16H,5,9,15H2,1H3,(H,25,27)
InChIKeyGFBSWCVJMYUNPX-UHFFFAOYSA-N
XLogP4.54
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone
CID 755245
N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109057111
3-amino-N-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]benzamide
CID 19607806
N-tert-butyl-3-(3,4-dihydro-2H-quinoline-1-carbonyl)benzamide
CID 109055995
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(2-methoxyethyl)benzamide
CID 109052567
1-(4-methoxybenzoyl)-N-(4-methoxyphenyl)-2,3-dihydroindole-6-carboxamide
CID 53160317
3-hydroxy-N-[4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]benzamide
CID 19607809
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)-N-methylbenzenesulfonamide
CID 26911133
3,4-dihydro-2H-quinolin-1-yl-(3-methylphenyl)methanone
CID 669077
3-methoxy-N-[4-(3-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]benzamide
CID 19607868
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide
CID 109150620
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-pentylbenzamide
CID 109056273

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide?
The IUPAC name of 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide (CID 109057134) is 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide.
What is the SMILES notation for 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide?
The canonical SMILES for 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide is COc1ccc(NC(=O)c2cccc(C(=O)N3CCCc4ccccc43)c2)cc1.
What is the InChIKey of 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide?
The InChIKey is GFBSWCVJMYUNPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c1-29-21-13-11-20(12-14-21)25-23(27)18-7-4-8-19(16-18)24(28)26-15-5-9-17-6-2-3-10-22(17)26/h2-4,6-8,10-14,16H,5,9,15H2,1H3,(H,25,27).
What are the key properties of 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide?
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide has a molecular weight of 386.45 g/mol, XLogP of 4.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide is sourced from PubChem (CID 109057134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).