3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one

C11H11NO2 — CID 101071705

IUPAC3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one
SMILESO=C1Nc2ccccc2C2OCCC12
InChIInChI=1S/C11H11NO2/c13-11-8-5-6-14-10(8)7-3-1-2-4-9(7)12-11/h1-4,8,10H,5-6H2,(H,12,13)
InChIKeyCGSBPTQZDIXHAJ-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.72
Rot. Bonds

About 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one

3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one (PubChem CID 101071705) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one.

Molecular Properties

Compound Name3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one
PubChem CID101071705
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one
SMILESO=C1Nc2ccccc2C2OCCC12
InChIInChI=1S/C11H11NO2/c13-11-8-5-6-14-10(8)7-3-1-2-4-9(7)12-11/h1-4,8,10H,5-6H2,(H,12,13)
InChIKeyCGSBPTQZDIXHAJ-UHFFFAOYSA-N
XLogP1.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,3,3a,5,9b-hexahydropyrrolo[3,4-c]quinolin-4-one;hydrochloride
CID 167311658
[(3R)-2-oxo-1,3-dihydroindol-3-yl]azanium
CID 6921460
5,6a,7,10,10a,11-hexahydrobenzo[b][1,4]benzodiazepin-6-one
CID 69466527
oxo-[(2-oxo-1,3-dihydroindol-3-yl)methyl]sulfanium
CID 175320984
3-(3-aminoprop-2-enyl)-1,3-dihydroindol-2-one
CID 70440034
(3aR,4R,9bS)-4-phenyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinoline
CID 11870146
3-(1-aminocyclopropyl)-1,3-dihydroindol-2-one
CID 83752879
2-(2-oxo-1,3-dihydroindol-3-yl)acetaldehyde
CID 22380583
(3aR,9bR)-2-benzyl-3,3a,5,9b-tetrahydro-1H-pyrrolo[3,4-c]quinolin-4-one
CID 124803001
3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one
CID 106986757
3-(cyclopentylmethylamino)-1,3-dihydroindol-2-one
CID 43370920
3-(thiophen-2-ylmethyl)-1,3-dihydroindol-2-one
CID 2803153

Frequently Asked Questions

What is the IUPAC name of 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one?
The IUPAC name of 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one (CID 101071705) is 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one.
What is the SMILES notation for 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one?
The canonical SMILES for 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one is O=C1Nc2ccccc2C2OCCC12.
What is the InChIKey of 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one?
The InChIKey is CGSBPTQZDIXHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c13-11-8-5-6-14-10(8)7-3-1-2-4-9(7)12-11/h1-4,8,10H,5-6H2,(H,12,13).
What are the key properties of 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one?
3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one has a molecular weight of 189.21 g/mol, XLogP of 1.72, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3a,5,9b-tetrahydro-2H-furo[3,2-c]quinolin-4-one is sourced from PubChem (CID 101071705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).