3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene

C15H20 — CID 173288618

IUPAC3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene
SMILESC=C(C)Cc1ccc2c(c1)C(C)(C)CC2
InChIInChI=1S/C15H20/c1-11(2)9-12-5-6-13-7-8-15(3,4)14(13)10-12/h5-6,10H,1,7-9H2,2-4H3
InChIKeyGULBMFGVOKCMAH-UHFFFAOYSA-N
MW200.32 g/mol
LogP4.03
Rot. Bonds2

About 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene

3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene (PubChem CID 173288618) has the molecular formula C15H20 and a molecular weight of 200.32 g/mol. Its IUPAC name is 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene.

Molecular Properties

Compound Name3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene
PubChem CID173288618
Molecular FormulaC15H20
Molecular Weight200.32 g/mol
Exact Mass200.16
IUPAC Name3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene
SMILESC=C(C)Cc1ccc2c(c1)C(C)(C)CC2
InChIInChI=1S/C15H20/c1-11(2)9-12-5-6-13-7-8-15(3,4)14(13)10-12/h5-6,10H,1,7-9H2,2-4H3
InChIKeyGULBMFGVOKCMAH-UHFFFAOYSA-N
XLogP4.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene?
The IUPAC name of 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene (CID 173288618) is 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene.
What is the SMILES notation for 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene?
The canonical SMILES for 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene is C=C(C)Cc1ccc2c(c1)C(C)(C)CC2.
What is the InChIKey of 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene?
The InChIKey is GULBMFGVOKCMAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20/c1-11(2)9-12-5-6-13-7-8-15(3,4)14(13)10-12/h5-6,10H,1,7-9H2,2-4H3.
What are the key properties of 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene?
3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene has a molecular weight of 200.32 g/mol, XLogP of 4.03, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-5-(2-methylprop-2-enyl)-1,2-dihydroindene is sourced from PubChem (CID 173288618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).