N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide

C18H15FN2O — CID 155510016

IUPACN-ethyl-2-(5-fluoroquinolin-3-yl)benzamide
SMILESCCNC(=O)c1ccccc1-c1cnc2cccc(F)c2c1
InChIInChI=1S/C18H15FN2O/c1-2-20-18(22)14-7-4-3-6-13(14)12-10-15-16(19)8-5-9-17(15)21-11-12/h3-11H,2H2,1H3,(H,20,22)
InChIKeyGTTXZKZCVJXLOY-UHFFFAOYSA-N
MW294.33 g/mol
LogP3.79
Rot. Bonds3

About N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide

N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide (PubChem CID 155510016) has the molecular formula C18H15FN2O and a molecular weight of 294.33 g/mol. Its IUPAC name is N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide.

Molecular Properties

Compound NameN-ethyl-2-(5-fluoroquinolin-3-yl)benzamide
PubChem CID155510016
Molecular FormulaC18H15FN2O
Molecular Weight294.33 g/mol
Exact Mass294.12
IUPAC NameN-ethyl-2-(5-fluoroquinolin-3-yl)benzamide
SMILESCCNC(=O)c1ccccc1-c1cnc2cccc(F)c2c1
InChIInChI=1S/C18H15FN2O/c1-2-20-18(22)14-7-4-3-6-13(14)12-10-15-16(19)8-5-9-17(15)21-11-12/h3-11H,2H2,1H3,(H,20,22)
InChIKeyGTTXZKZCVJXLOY-UHFFFAOYSA-N
XLogP3.79
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-[4-fluoro-3-(hydroxymethyl)phenyl]benzamide
CID 56704912
N-ethyl-6-(5-fluoroquinolin-3-yl)-N-methylpyridine-3-carboxamide
CID 155909866
N-ethyl-2-fluoro-3-phenylbenzamide
CID 67472653
4-anilino-N-ethyl-6-[3-fluoro-4-(methylcarbamoyl)phenyl]quinoline-3-carboxamide
CID 156547219
N-ethyl-2-(ethylamino)-3-fluorobenzamide
CID 62648907
N-(3-methoxypropyl)-2-(1H-pyrazolo[3,4-b]pyridin-5-yl)benzamide
CID 167970947
2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-ethylbenzamide
CID 100512374
2-[[6-(5-fluoroquinolin-3-yl)pyrimidin-4-yl]amino]ethanol
CID 155917158
N-ethyl-2-(2-sulfanylphenyl)benzamide
CID 139949970
2-[2,6-bis(ethylcarbamoyl)phenyl]-1-N,3-N-diethylbenzene-1,3-dicarboxamide
CID 4866653
methyl 3-phenylquinoline-5-carboxylate
CID 15789216
N-ethyl-2-[5-(4-methylphenyl)-1,3-oxazol-2-yl]benzamide
CID 134049112

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide?
The IUPAC name of N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide (CID 155510016) is N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide.
What is the SMILES notation for N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide?
The canonical SMILES for N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide is CCNC(=O)c1ccccc1-c1cnc2cccc(F)c2c1.
What is the InChIKey of N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide?
The InChIKey is GTTXZKZCVJXLOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O/c1-2-20-18(22)14-7-4-3-6-13(14)12-10-15-16(19)8-5-9-17(15)21-11-12/h3-11H,2H2,1H3,(H,20,22).
What are the key properties of N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide?
N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide has a molecular weight of 294.33 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide is sourced from PubChem (CID 155510016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).