6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane

C14H22O — CID 162867130

IUPAC6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane
SMILESC=C1CCCC2(C)CCC3CC12OC3C
InChIInChI=1S/C14H22O/c1-10-5-4-7-13(3)8-6-12-9-14(10,13)15-11(12)2/h11-12H,1,4-9H2,2-3H3
InChIKeyWGUNTNPJVPKOEM-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.69
Rot. Bonds

About 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane

6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane (PubChem CID 162867130) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane.

Molecular Properties

Compound Name6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane
PubChem CID162867130
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane
SMILESC=C1CCCC2(C)CCC3CC12OC3C
InChIInChI=1S/C14H22O/c1-10-5-4-7-13(3)8-6-12-9-14(10,13)15-11(12)2/h11-12H,1,4-9H2,2-3H3
InChIKeyWGUNTNPJVPKOEM-UHFFFAOYSA-N
XLogP3.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1S,6R)-6-methyl-2,10-dimethylidene-12-oxatricyclo[7.3.1.01,6]tridecan-11-one
CID 162912447
(2R,5S)-2,6,6-trimethyl-10-methylidene-1-oxaspiro[4.5]decane
CID 56843547
(3aR,5aR,9aS)-2,2,5a-trimethyl-9-methylidene-3a,4,5,6,7,8-hexahydroindeno[1,7a-d][1,3]dioxole
CID 101388554
(3S,3aS,5aR,9aR,9bR)-9a-hydroxy-3,5a-dimethyl-9-methylidene-3,3a,4,5,6,7,8,9b-octahydrobenzo[g][1]benzofuran-2-one
CID 102078370
(1R,9R)-6,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-2-one
CID 5320214
(3S,4aS,8aR)-8a-methyl-5-methylidene-3-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-4a-ol
CID 163013816
2,6,6,7-tetramethyl-10-methylidene-1-oxaspiro[4.5]decane
CID 154173726
2-(8a-hydroxy-4a-methyl-8-methylidene-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)prop-2-enoic acid
CID 14705650
4-methylidenespiro[4.4]nonane
CID 565056
(7aS)-3,3a,7a-trimethyl-7-methylidene-1,2,3,4,5,6-hexahydroindene
CID 142040575
methyl 2-[(2R,4aR,8aS)-8a-hydroperoxy-4a-methyl-8-methylidene-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]prop-2-enoate
CID 162856359
2-(8a-hydroxy-4a-methyl-8-methylidene-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)propane-1,2-diol
CID 14315352

Frequently Asked Questions

What is the IUPAC name of 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane?
The IUPAC name of 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane (CID 162867130) is 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane.
What is the SMILES notation for 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane?
The canonical SMILES for 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane is C=C1CCCC2(C)CCC3CC12OC3C.
What is the InChIKey of 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane?
The InChIKey is WGUNTNPJVPKOEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-10-5-4-7-13(3)8-6-12-9-14(10,13)15-11(12)2/h11-12H,1,4-9H2,2-3H3.
What are the key properties of 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane?
6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane has a molecular weight of 206.33 g/mol, XLogP of 3.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,10-dimethyl-2-methylidene-11-oxatricyclo[7.2.1.01,6]dodecane is sourced from PubChem (CID 162867130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).