(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone

C14H15F2NO2 — CID 128950679

IUPAC(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
SMILESO=C(C1CCOC1)N1CCCc2cc(F)c(F)cc21
InChIInChI=1S/C14H15F2NO2/c15-11-6-9-2-1-4-17(13(9)7-12(11)16)14(18)10-3-5-19-8-10/h6-7,10H,1-5,8H2
InChIKeyZFEJHTUROOXPMO-UHFFFAOYSA-N
MW267.27 g/mol
LogP2.28
Rot. Bonds1

About (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone

(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone (PubChem CID 128950679) has the molecular formula C14H15F2NO2 and a molecular weight of 267.27 g/mol. Its IUPAC name is (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone.

Molecular Properties

Compound Name(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
PubChem CID128950679
Molecular FormulaC14H15F2NO2
Molecular Weight267.27 g/mol
Exact Mass267.11
IUPAC Name(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
SMILESO=C(C1CCOC1)N1CCCc2cc(F)c(F)cc21
InChIInChI=1S/C14H15F2NO2/c15-11-6-9-2-1-4-17(13(9)7-12(11)16)14(18)10-3-5-19-8-10/h6-7,10H,1-5,8H2
InChIKeyZFEJHTUROOXPMO-UHFFFAOYSA-N
XLogP2.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.27
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone with MolForge

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Related Compounds

[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 98672598
3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone
CID 71879683
oxan-4-yl-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]methanone
CID 52572016
(9-amino-3-bicyclo[3.3.1]nonanyl)-(5,6-difluoro-2,3-dihydroindol-1-yl)methanone
CID 120986068
(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(furan-3-yl)methanone
CID 39139403
oxolan-3-yl(1,2,3,4-tetrahydro-1,5-benzodiazepin-5-yl)methanone
CID 64851976
(5-amino-3,4-dihydro-2H-quinolin-1-yl)-(oxan-3-yl)methanone
CID 82705671
(6-amino-3,4-dihydro-2H-quinolin-1-yl)-(1,4-dioxan-2-yl)methanone
CID 55119994
1-[1-(cyclopropanecarbonyl)-3,4-dihydro-2H-quinolin-7-yl]-3-(oxan-4-yl)urea
CID 110623344
(4-hydroxyimino-2,3-dihydroquinolin-1-yl)-(oxolan-3-yl)methanone
CID 77033492
1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 132513887
oxolan-3-yl(5,6,7,8-tetrahydronaphthalen-2-yl)methanone
CID 61272773

Frequently Asked Questions

What is the IUPAC name of (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone?
The IUPAC name of (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone (CID 128950679) is (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone.
What is the SMILES notation for (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone?
The canonical SMILES for (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone is O=C(C1CCOC1)N1CCCc2cc(F)c(F)cc21.
What is the InChIKey of (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone?
The InChIKey is ZFEJHTUROOXPMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2NO2/c15-11-6-9-2-1-4-17(13(9)7-12(11)16)14(18)10-3-5-19-8-10/h6-7,10H,1-5,8H2.
What are the key properties of (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone?
(6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone has a molecular weight of 267.27 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6,7-difluoro-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone is sourced from PubChem (CID 128950679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).