1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran

C13H14O — CID 86734226

IUPAC1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran
SMILESCC1OCCC2=C1Cc1ccccc12
InChIInChI=1S/C13H14O/c1-9-13-8-10-4-2-3-5-11(10)12(13)6-7-14-9/h2-5,9H,6-8H2,1H3
InChIKeyQQMSCRGPTBBFOG-UHFFFAOYSA-N
MW186.25 g/mol
LogP2.81
Rot. Bonds

About 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran

1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran (PubChem CID 86734226) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran.

Molecular Properties

Compound Name1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran
PubChem CID86734226
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran
SMILESCC1OCCC2=C1Cc1ccccc12
InChIInChI=1S/C13H14O/c1-9-13-8-10-4-2-3-5-11(10)12(13)6-7-14-9/h2-5,9H,6-8H2,1H3
InChIKeyQQMSCRGPTBBFOG-UHFFFAOYSA-N
XLogP2.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

trimethyl(2,3,4,9-tetrahydro-1H-fluoren-1-yl)azanium
CID 151821101
9H-fluorene;trihydrofluoride
CID 172854917
ethane;pentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4,6,8,13,15,17-octaene
CID 123798005
[(1R,12bR)-1-methyl-3,4,6,7,12,12b-hexahydro-2H-indeno[2,1-a]quinolizin-1-yl]methanol
CID 10308180
bicyclo[4.2.0]octa-1,3,5-triene;9H-fluorene
CID 161235205
methanol;2,3,4,9-tetrahydro-1H-fluorene
CID 172707139
cadmium;9H-fluorene
CID 175337736
azane;hexakis(9H-fluorene)
CID 158472914
chromium;9H-fluorene
CID 161167703
N,N-dimethyl-1-(1-methyl-4,9-dihydro-3H-indeno[2,1-c]pyran-1-yl)methanamine;hydrochloride
CID 21495356
6,7,8,9,10,11,12,13,14,15-decahydro-5H-cyclododeca[a]indene
CID 14952510
12-methyl-1,2,3,4,5,6,11,12-octahydrochrysene
CID 147219193

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran?
The IUPAC name of 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran (CID 86734226) is 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran.
What is the SMILES notation for 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran?
The canonical SMILES for 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran is CC1OCCC2=C1Cc1ccccc12.
What is the InChIKey of 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran?
The InChIKey is QQMSCRGPTBBFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-9-13-8-10-4-2-3-5-11(10)12(13)6-7-14-9/h2-5,9H,6-8H2,1H3.
What are the key properties of 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran?
1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran has a molecular weight of 186.25 g/mol, XLogP of 2.81, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1,3,4,9-tetrahydroindeno[2,1-c]pyran is sourced from PubChem (CID 86734226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).