4-ethenyl-N-(6-methylquinolin-8-yl)benzamide

C19H16N2O — CID 166188800

IUPAC4-ethenyl-N-(6-methylquinolin-8-yl)benzamide
SMILESC=Cc1ccc(C(=O)Nc2cc(C)cc3cccnc23)cc1
InChIInChI=1S/C19H16N2O/c1-3-14-6-8-15(9-7-14)19(22)21-17-12-13(2)11-16-5-4-10-20-18(16)17/h3-12H,1H2,2H3,(H,21,22)
InChIKeySNWCJWMCDGDWGD-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.44
Rot. Bonds3

About 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide

4-ethenyl-N-(6-methylquinolin-8-yl)benzamide (PubChem CID 166188800) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide.

Molecular Properties

Compound Name4-ethenyl-N-(6-methylquinolin-8-yl)benzamide
PubChem CID166188800
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name4-ethenyl-N-(6-methylquinolin-8-yl)benzamide
SMILESC=Cc1ccc(C(=O)Nc2cc(C)cc3cccnc23)cc1
InChIInChI=1S/C19H16N2O/c1-3-14-6-8-15(9-7-14)19(22)21-17-12-13(2)11-16-5-4-10-20-18(16)17/h3-12H,1H2,2H3,(H,21,22)
InChIKeySNWCJWMCDGDWGD-UHFFFAOYSA-N
XLogP4.44
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide?
The IUPAC name of 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide (CID 166188800) is 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide.
What is the SMILES notation for 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide?
The canonical SMILES for 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide is C=Cc1ccc(C(=O)Nc2cc(C)cc3cccnc23)cc1.
What is the InChIKey of 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide?
The InChIKey is SNWCJWMCDGDWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c1-3-14-6-8-15(9-7-14)19(22)21-17-12-13(2)11-16-5-4-10-20-18(16)17/h3-12H,1H2,2H3,(H,21,22).
What are the key properties of 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide?
4-ethenyl-N-(6-methylquinolin-8-yl)benzamide has a molecular weight of 288.35 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-N-(6-methylquinolin-8-yl)benzamide is sourced from PubChem (CID 166188800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).