3-methyl-N-quinolin-8-ylbenzamide

C17H14N2O — CID 849605

IUPAC3-methyl-N-quinolin-8-ylbenzamide
SMILESCc1cccc(C(=O)Nc2cccc3cccnc23)c1
InChIInChI=1S/C17H14N2O/c1-12-5-2-7-14(11-12)17(20)19-15-9-3-6-13-8-4-10-18-16(13)15/h2-11H,1H3,(H,19,20)
InChIKeyYMYOMPUTQPZVKT-UHFFFAOYSA-N
MW262.31 g/mol
LogP3.80
Rot. Bonds2

About 3-methyl-N-quinolin-8-ylbenzamide

3-methyl-N-quinolin-8-ylbenzamide (PubChem CID 849605) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 3-methyl-N-quinolin-8-ylbenzamide.

Molecular Properties

Compound Name3-methyl-N-quinolin-8-ylbenzamide
PubChem CID849605
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name3-methyl-N-quinolin-8-ylbenzamide
SMILESCc1cccc(C(=O)Nc2cccc3cccnc23)c1
InChIInChI=1S/C17H14N2O/c1-12-5-2-7-14(11-12)17(20)19-15-9-3-6-13-8-4-10-18-16(13)15/h2-11H,1H3,(H,19,20)
InChIKeyYMYOMPUTQPZVKT-UHFFFAOYSA-N
XLogP3.80
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-quinolin-8-ylbenzamide?
The IUPAC name of 3-methyl-N-quinolin-8-ylbenzamide (CID 849605) is 3-methyl-N-quinolin-8-ylbenzamide.
What is the SMILES notation for 3-methyl-N-quinolin-8-ylbenzamide?
The canonical SMILES for 3-methyl-N-quinolin-8-ylbenzamide is Cc1cccc(C(=O)Nc2cccc3cccnc23)c1.
What is the InChIKey of 3-methyl-N-quinolin-8-ylbenzamide?
The InChIKey is YMYOMPUTQPZVKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O/c1-12-5-2-7-14(11-12)17(20)19-15-9-3-6-13-8-4-10-18-16(13)15/h2-11H,1H3,(H,19,20).
What are the key properties of 3-methyl-N-quinolin-8-ylbenzamide?
3-methyl-N-quinolin-8-ylbenzamide has a molecular weight of 262.31 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-quinolin-8-ylbenzamide is sourced from PubChem (CID 849605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).