(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone

C16H15FN2O — CID 134002037

IUPAC(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone
SMILESCc1cccc(C(=O)N2CCCc3cccc(F)c32)n1
InChIInChI=1S/C16H15FN2O/c1-11-5-2-9-14(18-11)16(20)19-10-4-7-12-6-3-8-13(17)15(12)19/h2-3,5-6,8-9H,4,7,10H2,1H3
InChIKeyKTQCECFZQDGDRR-UHFFFAOYSA-N
MW270.31 g/mol
LogP3.12
Rot. Bonds1

About (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone

(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone (PubChem CID 134002037) has the molecular formula C16H15FN2O and a molecular weight of 270.31 g/mol. Its IUPAC name is (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone.

Molecular Properties

Compound Name(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone
PubChem CID134002037
Molecular FormulaC16H15FN2O
Molecular Weight270.31 g/mol
Exact Mass270.12
IUPAC Name(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone
SMILESCc1cccc(C(=O)N2CCCc3cccc(F)c32)n1
InChIInChI=1S/C16H15FN2O/c1-11-5-2-9-14(18-11)16(20)19-10-4-7-12-6-3-8-13(17)15(12)19/h2-3,5-6,8-9H,4,7,10H2,1H3
InChIKeyKTQCECFZQDGDRR-UHFFFAOYSA-N
XLogP3.12
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(8-fluoro-3,4-dihydro-2H-quinoline-1-carbonyl)-1H-pyridazin-6-one
CID 110744009
(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-pyrazin-2-ylmethanone
CID 110744006
(7-amino-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone
CID 62265851
(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 95930576
2,3-dihydroindol-1-yl-(6-methyl-2-pyridinyl)methanone
CID 33315959
(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(3-fluoro-4-methoxyphenyl)methanone
CID 78843598
N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide
CID 109100371
1-(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-2-(4-methylphenyl)sulfanylethanone
CID 134052350
[2-(2,6-difluoroanilino)-6-methylpyrimidin-4-yl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109335606
6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxylic acid
CID 43558372
N-tert-butyl-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide
CID 109099143
1-(6-methylpyridine-2-carbonyl)piperidin-4-one
CID 24708249

Frequently Asked Questions

What is the IUPAC name of (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone?
The IUPAC name of (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone (CID 134002037) is (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone.
What is the SMILES notation for (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone?
The canonical SMILES for (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone is Cc1cccc(C(=O)N2CCCc3cccc(F)c32)n1.
What is the InChIKey of (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone?
The InChIKey is KTQCECFZQDGDRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O/c1-11-5-2-9-14(18-11)16(20)19-10-4-7-12-6-3-8-13(17)15(12)19/h2-3,5-6,8-9H,4,7,10H2,1H3.
What are the key properties of (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone?
(8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone has a molecular weight of 270.31 g/mol, XLogP of 3.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-fluoro-3,4-dihydro-2H-quinolin-1-yl)-(6-methyl-2-pyridinyl)methanone is sourced from PubChem (CID 134002037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).