3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one

C17H15NO2 — CID 105121476

IUPAC3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one
SMILESCc1ccc2cc(C(=O)CCc3ccco3)ccc2n1
InChIInChI=1S/C17H15NO2/c1-12-4-5-13-11-14(6-8-16(13)18-12)17(19)9-7-15-3-2-10-20-15/h2-6,8,10-11H,7,9H2,1H3
InChIKeyOVULFNMNUQUFKX-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.95
Rot. Bonds4

About 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one

3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one (PubChem CID 105121476) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one.

Molecular Properties

Compound Name3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one
PubChem CID105121476
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one
SMILESCc1ccc2cc(C(=O)CCc3ccco3)ccc2n1
InChIInChI=1S/C17H15NO2/c1-12-4-5-13-11-14(6-8-16(13)18-12)17(19)9-7-15-3-2-10-20-15/h2-6,8,10-11H,7,9H2,1H3
InChIKeyOVULFNMNUQUFKX-UHFFFAOYSA-N
XLogP3.95
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylquinolin-6-yl)-3-pyridin-3-ylpropan-1-one
CID 105121412
1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-one
CID 105095849
6-amino-1-(2-methylquinolin-6-yl)hexan-1-one
CID 116549997
1-(3,5-difluorophenyl)-3-(furan-2-yl)propan-1-one
CID 105095139
3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-amine
CID 105172248
1-(2-methylquinolin-6-yl)-2-thiophen-2-ylethanone
CID 81221087
2-cyclobutyl-1-(2-methylquinolin-6-yl)ethanone
CID 103168015
3-(furan-2-yl)-N-methyl-1-(2-methylquinolin-6-yl)propan-1-amine
CID 105172256
2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one
CID 103446086
3-(furan-2-yl)-1-(4-propan-2-yloxyphenyl)propan-1-one
CID 105097418
3-(furan-2-yl)-1-[3-(trifluoromethoxy)phenyl]propan-1-one
CID 105098497
2-(1-aminocyclohexyl)-1-(2-methylquinolin-6-yl)ethanone
CID 116578986

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one?
The IUPAC name of 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one (CID 105121476) is 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one.
What is the SMILES notation for 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one?
The canonical SMILES for 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one is Cc1ccc2cc(C(=O)CCc3ccco3)ccc2n1.
What is the InChIKey of 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one?
The InChIKey is OVULFNMNUQUFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-12-4-5-13-11-14(6-8-16(13)18-12)17(19)9-7-15-3-2-10-20-15/h2-6,8,10-11H,7,9H2,1H3.
What are the key properties of 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one?
3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one has a molecular weight of 265.31 g/mol, XLogP of 3.95, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-one is sourced from PubChem (CID 105121476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).