N-quinolin-2-ylbenzamide

C16H12N2O — CID 2812454

IUPACN-quinolin-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2n1)c1ccccc1
InChIInChI=1S/C16H12N2O/c19-16(13-7-2-1-3-8-13)18-15-11-10-12-6-4-5-9-14(12)17-15/h1-11H,(H,17,18,19)
InChIKeyWPCHNALOYAPYPN-UHFFFAOYSA-N
MW248.28 g/mol
LogP3.49
Rot. Bonds2

About N-quinolin-2-ylbenzamide

N-quinolin-2-ylbenzamide (PubChem CID 2812454) has the molecular formula C16H12N2O and a molecular weight of 248.28 g/mol. Its IUPAC name is N-quinolin-2-ylbenzamide.

Molecular Properties

Compound NameN-quinolin-2-ylbenzamide
PubChem CID2812454
Molecular FormulaC16H12N2O
Molecular Weight248.28 g/mol
Exact Mass248.09
IUPAC NameN-quinolin-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2n1)c1ccccc1
InChIInChI=1S/C16H12N2O/c19-16(13-7-2-1-3-8-13)18-15-11-10-12-6-4-5-9-14(12)17-15/h1-11H,(H,17,18,19)
InChIKeyWPCHNALOYAPYPN-UHFFFAOYSA-N
XLogP3.49
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-quinolin-2-ylbenzamide?
The IUPAC name of N-quinolin-2-ylbenzamide (CID 2812454) is N-quinolin-2-ylbenzamide.
What is the SMILES notation for N-quinolin-2-ylbenzamide?
The canonical SMILES for N-quinolin-2-ylbenzamide is O=C(Nc1ccc2ccccc2n1)c1ccccc1.
What is the InChIKey of N-quinolin-2-ylbenzamide?
The InChIKey is WPCHNALOYAPYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O/c19-16(13-7-2-1-3-8-13)18-15-11-10-12-6-4-5-9-14(12)17-15/h1-11H,(H,17,18,19).
What are the key properties of N-quinolin-2-ylbenzamide?
N-quinolin-2-ylbenzamide has a molecular weight of 248.28 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinolin-2-ylbenzamide is sourced from PubChem (CID 2812454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).