7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene

C15H24 — CID 164529305

IUPAC7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene
SMILESC=C1CC(C)(C)C2=C1C(C)(CC)CCC2
InChIInChI=1S/C15H24/c1-6-15(5)9-7-8-12-13(15)11(2)10-14(12,3)4/h2,6-10H2,1,3-5H3
InChIKeyANCDGUUVOHQAJX-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.87
Rot. Bonds1

About 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene

7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene (PubChem CID 164529305) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene.

Molecular Properties

Compound Name7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene
PubChem CID164529305
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene
SMILESC=C1CC(C)(C)C2=C1C(C)(CC)CCC2
InChIInChI=1S/C15H24/c1-6-15(5)9-7-8-12-13(15)11(2)10-14(12,3)4/h2,6-10H2,1,3-5H3
InChIKeyANCDGUUVOHQAJX-UHFFFAOYSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene?
The IUPAC name of 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene (CID 164529305) is 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene.
What is the SMILES notation for 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene?
The canonical SMILES for 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene is C=C1CC(C)(C)C2=C1C(C)(CC)CCC2.
What is the InChIKey of 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene?
The InChIKey is ANCDGUUVOHQAJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-6-15(5)9-7-8-12-13(15)11(2)10-14(12,3)4/h2,6-10H2,1,3-5H3.
What are the key properties of 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene?
7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene has a molecular weight of 204.36 g/mol, XLogP of 4.87, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-3,3,7-trimethyl-1-methylidene-2,4,5,6-tetrahydroindene is sourced from PubChem (CID 164529305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).