3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide

C20H18F2N2O2 — CID 110674043

IUPAC3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide
SMILESO=C(CCc1cc2cc(F)ccc2[nH]c1=O)NCCc1ccccc1F
InChIInChI=1S/C20H18F2N2O2/c21-16-6-7-18-15(12-16)11-14(20(26)24-18)5-8-19(25)23-10-9-13-3-1-2-4-17(13)22/h1-4,6-7,11-12H,5,8-10H2,(H,23,25)(H,24,26)
InChIKeyHVGPEHNVEKIINF-UHFFFAOYSA-N
MW356.37 g/mol
LogP3.10
Rot. Bonds6

About 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide

3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide (PubChem CID 110674043) has the molecular formula C20H18F2N2O2 and a molecular weight of 356.37 g/mol. Its IUPAC name is 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide
PubChem CID110674043
Molecular FormulaC20H18F2N2O2
Molecular Weight356.37 g/mol
Exact Mass356.13
IUPAC Name3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide
SMILESO=C(CCc1cc2cc(F)ccc2[nH]c1=O)NCCc1ccccc1F
InChIInChI=1S/C20H18F2N2O2/c21-16-6-7-18-15(12-16)11-14(20(26)24-18)5-8-19(25)23-10-9-13-3-1-2-4-17(13)22/h1-4,6-7,11-12H,5,8-10H2,(H,23,25)(H,24,26)
InChIKeyHVGPEHNVEKIINF-UHFFFAOYSA-N
XLogP3.10
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.37
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-fluorophenyl)methyl]-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331295
N-[2-(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(2-fluorophenyl)propanamide
CID 110415422
4-(4-fluorophenyl)-N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]butanamide
CID 110415150
5-(4-fluorophenyl)-5-oxo-N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]pentanamide
CID 110413637
3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide
CID 110406226
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 110331644
3-(2-oxo-1H-quinolin-3-yl)-N-(3-phenylpropyl)propanamide
CID 110330993
N-(3-methylbutyl)-3-(2-oxo-1H-quinolin-3-yl)propanamide
CID 110330998
N-[2-(2,5-difluorophenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 110788190
2-(7-fluoro-2-oxo-1H-quinolin-3-yl)ethylcarbamic acid
CID 118936154
N-(2,6-difluorophenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 110428860
4-(4-chlorophenyl)-N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]butanamide
CID 110413628

Frequently Asked Questions

What is the IUPAC name of 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The IUPAC name of 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide (CID 110674043) is 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide.
What is the SMILES notation for 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The canonical SMILES for 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide is O=C(CCc1cc2cc(F)ccc2[nH]c1=O)NCCc1ccccc1F.
What is the InChIKey of 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide?
The InChIKey is HVGPEHNVEKIINF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18F2N2O2/c21-16-6-7-18-15(12-16)11-14(20(26)24-18)5-8-19(25)23-10-9-13-3-1-2-4-17(13)22/h1-4,6-7,11-12H,5,8-10H2,(H,23,25)(H,24,26).
What are the key properties of 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide?
3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide has a molecular weight of 356.37 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-fluoro-2-oxo-1H-quinolin-3-yl)-N-[2-(2-fluorophenyl)ethyl]propanamide is sourced from PubChem (CID 110674043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).