11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene

C13H14O2 — CID 121395463

IUPAC11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene
SMILESCC12CCC3(O1)c1ccccc1CC3O2
InChIInChI=1S/C13H14O2/c1-12-6-7-13(15-12)10-5-3-2-4-9(10)8-11(13)14-12/h2-5,11H,6-8H2,1H3
InChIKeyGYUIAZPTRPLJQW-UHFFFAOYSA-N
MW202.25 g/mol
LogP2.36
Rot. Bonds

About 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene

11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene (PubChem CID 121395463) has the molecular formula C13H14O2 and a molecular weight of 202.25 g/mol. Its IUPAC name is 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene.

Molecular Properties

Compound Name11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene
PubChem CID121395463
Molecular FormulaC13H14O2
Molecular Weight202.25 g/mol
Exact Mass202.10
IUPAC Name11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene
SMILESCC12CCC3(O1)c1ccccc1CC3O2
InChIInChI=1S/C13H14O2/c1-12-6-7-13(15-12)10-5-3-2-4-9(10)8-11(13)14-12/h2-5,11H,6-8H2,1H3
InChIKeyGYUIAZPTRPLJQW-UHFFFAOYSA-N
XLogP2.36
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-iodo-3,3-dimethyl-1,2-dihydroindene
CID 70493700
(1R,10R,13S)-13-methyl-9,14,15,17-tetraoxatetracyclo[11.2.2.01,10.02,7]heptadeca-2,4,6-triene
CID 66556677
(3aS,8bR)-8b-but-3-enyl-2,2-dimethyl-3a,4-dihydroindeno[1,2-d][1,3]dioxole
CID 122215645
(1S,10S,12S)-8,12-dimethyl-11,13,14-trioxatetracyclo[10.2.2.01,10.02,7]hexadeca-2,4,6,8-tetraene
CID 134927955
(3aS,8bR)-8b-methyl-3a,4-dihydro-3H-indeno[1,2-b]furan-2-one
CID 11240906
3,3-dimethyl-2-propan-2-yl-1,2-dihydroindene
CID 22975328
13,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-trien-1-ol
CID 58123800
(4bS,8aR,9S)-4b-methyl-6,7,8,8a,9,10-hexahydro-5H-phenanthren-9-amine
CID 124676605
(9bR)-2,2,9b-trimethyl-4,5-dihydro-3aH-benzo[g][1,3]benzodioxole
CID 121400495
5,7-dimethyl-7-phenyl-6,8-dioxabicyclo[3.2.1]octane
CID 14545113
(1R,9S,13S)-1,10,13-trimethyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene;hydrobromide
CID 3048328
1,1,2,3-tetramethyl-3,4-dihydronaphthalen-2-amine
CID 18983557

Frequently Asked Questions

What is the IUPAC name of 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene?
The IUPAC name of 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene (CID 121395463) is 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene.
What is the SMILES notation for 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene?
The canonical SMILES for 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene is CC12CCC3(O1)c1ccccc1CC3O2.
What is the InChIKey of 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene?
The InChIKey is GYUIAZPTRPLJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O2/c1-12-6-7-13(15-12)10-5-3-2-4-9(10)8-11(13)14-12/h2-5,11H,6-8H2,1H3.
What are the key properties of 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene?
11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene has a molecular weight of 202.25 g/mol, XLogP of 2.36, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-10,14-dioxatetracyclo[9.2.1.01,9.02,7]tetradeca-2,4,6-triene is sourced from PubChem (CID 121395463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).