7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one

C12H13NO2 — CID 82278075

IUPAC7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one
SMILESCOc1ccc2c(c1)NCC1(CC1)C2=O
InChIInChI=1S/C12H13NO2/c1-15-8-2-3-9-10(6-8)13-7-12(4-5-12)11(9)14/h2-3,6,13H,4-5,7H2,1H3
InChIKeyDBQXZJIUPXWEJE-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.08
Rot. Bonds1

About 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one

7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one (PubChem CID 82278075) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one.

Molecular Properties

Compound Name7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one
PubChem CID82278075
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one
SMILESCOc1ccc2c(c1)NCC1(CC1)C2=O
InChIInChI=1S/C12H13NO2/c1-15-8-2-3-9-10(6-8)13-7-12(4-5-12)11(9)14/h2-3,6,13H,4-5,7H2,1H3
InChIKeyDBQXZJIUPXWEJE-UHFFFAOYSA-N
XLogP2.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one with MolForge

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Related Compounds

7-methoxyspiro[2H-chromene-3,1'-cyclopropane]-4-one
CID 82277925
4',4'-difluoro-5-methoxyspiro[1,2-dihydroindole-3,1'-cyclohexane]
CID 106701810
3,3-diethyl-7-methoxy-4,5-dihydro-1H-1,5-benzodiazepin-2-one
CID 113308841
8-methoxy-3-methyl-1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one
CID 83218286
8-methoxyspiro[2,5-dihydro-1,5-benzothiazepine-3,1'-cyclopropane]-4-one
CID 115099183
ethene;5-methoxyspiro[3H-indene-2,4'-cyclohexane]-1,1'-dione
CID 161055612
9-methoxy-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one
CID 131887871
6'-methoxyspiro[1,3,5-trioxocane-7,2'-3,4-dihydronaphthalene]-1'-one
CID 135016415
2,2-bis(hydroxymethyl)-6-methoxy-3,4-dihydronaphthalen-1-one
CID 102026561
(3S)-7-methoxy-3-methyl-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one
CID 66651136
3-fluoro-7-methoxy-3-methyl-2,4-dihydro-1H-quinoline
CID 84720514
7-methoxy-2,2-dimethyl-3,4-dihydro-1λ6,4-benzothiazine 1,1-dioxide
CID 84630049

Frequently Asked Questions

What is the IUPAC name of 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one?
The IUPAC name of 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one (CID 82278075) is 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one.
What is the SMILES notation for 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one?
The canonical SMILES for 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one is COc1ccc2c(c1)NCC1(CC1)C2=O.
What is the InChIKey of 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one?
The InChIKey is DBQXZJIUPXWEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c1-15-8-2-3-9-10(6-8)13-7-12(4-5-12)11(9)14/h2-3,6,13H,4-5,7H2,1H3.
What are the key properties of 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one?
7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one has a molecular weight of 203.24 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxyspiro[1,2-dihydroquinoline-3,1'-cyclopropane]-4-one is sourced from PubChem (CID 82278075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).