2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide

C23H15FN2O2 — CID 39975789

IUPAC2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C23H15FN2O2/c24-17-11-9-15(10-12-17)22(27)19-6-2-3-7-20(19)23(28)26-18-13-16-5-1-4-8-21(16)25-14-18/h1-14H,(H,26,28)
InChIKeyMDPVSHPHCKWKOZ-UHFFFAOYSA-N
MW370.38 g/mol
LogP4.86
Rot. Bonds4

About 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide

2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide (PubChem CID 39975789) has the molecular formula C23H15FN2O2 and a molecular weight of 370.38 g/mol. Its IUPAC name is 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide.

Molecular Properties

Compound Name2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide
PubChem CID39975789
Molecular FormulaC23H15FN2O2
Molecular Weight370.38 g/mol
Exact Mass370.11
IUPAC Name2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C23H15FN2O2/c24-17-11-9-15(10-12-17)22(27)19-6-2-3-7-20(19)23(28)26-18-13-16-5-1-4-8-21(16)25-14-18/h1-14H,(H,26,28)
InChIKeyMDPVSHPHCKWKOZ-UHFFFAOYSA-N
XLogP4.86
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.38
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(methylamino)-N-quinolin-3-ylpyridine-3-carboxamide
CID 62808644
2-benzoyl-N-(7-methoxyquinolin-3-yl)benzamide
CID 54773922
3-amino-4-fluoro-N-quinolin-3-ylbenzamide
CID 61111864
4-methyl-N-quinolin-3-ylbenzamide
CID 974969
4-bromo-N-quinolin-3-ylbenzamide
CID 3301629
2-chloro-5-hydroxy-N-quinolin-3-ylbenzamide
CID 106501765
6-chloro-N-quinolin-3-ylpyridine-3-carboxamide
CID 29330391
2-amino-3-chloro-N-quinolin-3-ylbenzamide
CID 115540223
3-amino-2-methyl-N-quinolin-3-ylbenzamide
CID 61111679
2-(dimethylamino)-N-quinolin-3-ylpyridine-3-carboxamide
CID 38938974
3-(4-bromobenzoyl)-N-quinolin-3-ylindolizine-1-carboxamide
CID 168677971
2,4,5-trimethoxy-N-quinolin-3-ylbenzamide
CID 18146468

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide?
The IUPAC name of 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide (CID 39975789) is 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide.
What is the SMILES notation for 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide?
The canonical SMILES for 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide is O=C(Nc1cnc2ccccc2c1)c1ccccc1C(=O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide?
The InChIKey is MDPVSHPHCKWKOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15FN2O2/c24-17-11-9-15(10-12-17)22(27)19-6-2-3-7-20(19)23(28)26-18-13-16-5-1-4-8-21(16)25-14-18/h1-14H,(H,26,28).
What are the key properties of 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide?
2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide has a molecular weight of 370.38 g/mol, XLogP of 4.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorobenzoyl)-N-quinolin-3-ylbenzamide is sourced from PubChem (CID 39975789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).