6-tert-butyl-2,3-dimethylidene-1H-indene

C15H18 — CID 58981235

IUPAC6-tert-butyl-2,3-dimethylidene-1H-indene
SMILESC=C1Cc2cc(C(C)(C)C)ccc2C1=C
InChIInChI=1S/C15H18/c1-10-8-12-9-13(15(3,4)5)6-7-14(12)11(10)2/h6-7,9H,1-2,8H2,3-5H3
InChIKeyJQACJIJLEQJZSZ-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.11
Rot. Bonds

About 6-tert-butyl-2,3-dimethylidene-1H-indene

6-tert-butyl-2,3-dimethylidene-1H-indene (PubChem CID 58981235) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 6-tert-butyl-2,3-dimethylidene-1H-indene.

Molecular Properties

Compound Name6-tert-butyl-2,3-dimethylidene-1H-indene
PubChem CID58981235
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name6-tert-butyl-2,3-dimethylidene-1H-indene
SMILESC=C1Cc2cc(C(C)(C)C)ccc2C1=C
InChIInChI=1S/C15H18/c1-10-8-12-9-13(15(3,4)5)6-7-14(12)11(10)2/h6-7,9H,1-2,8H2,3-5H3
InChIKeyJQACJIJLEQJZSZ-UHFFFAOYSA-N
XLogP4.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 174369876
2-tert-butyl-7-(4-tert-butyl-5,6-dimethylidenecyclohexa-1,3-dien-1-yl)-9H-fluorene;ethane
CID 144503486
2-[7-(2-sulfanylpropan-2-yl)-9H-fluoren-2-yl]propane-2-thiol
CID 167021696
dilithium bis(2,7-ditert-butyl-1,9-dihydrofluoren-1-ide)
CID 159501718
5-tert-butyl-2,3-dihydro-1H-indene
CID 15271758
5-tert-butyl-2-methylidene-3H-1-benzothiophene
CID 158663471
(2E)-5-tert-butyl-2-hydroxyimino-3H-inden-1-one
CID 24777654
CID 23078665
CID 23078665
2,6-ditert-butyl-1,4-dihydronaphthalene
CID 10263787
2,7-ditert-butyl-9H-fluorene-4-carbaldehyde
CID 87824712
2,2,5-tritert-butyl-1,3-dihydroindene
CID 165164993

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-2,3-dimethylidene-1H-indene?
The IUPAC name of 6-tert-butyl-2,3-dimethylidene-1H-indene (CID 58981235) is 6-tert-butyl-2,3-dimethylidene-1H-indene.
What is the SMILES notation for 6-tert-butyl-2,3-dimethylidene-1H-indene?
The canonical SMILES for 6-tert-butyl-2,3-dimethylidene-1H-indene is C=C1Cc2cc(C(C)(C)C)ccc2C1=C.
What is the InChIKey of 6-tert-butyl-2,3-dimethylidene-1H-indene?
The InChIKey is JQACJIJLEQJZSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-10-8-12-9-13(15(3,4)5)6-7-14(12)11(10)2/h6-7,9H,1-2,8H2,3-5H3.
What are the key properties of 6-tert-butyl-2,3-dimethylidene-1H-indene?
6-tert-butyl-2,3-dimethylidene-1H-indene has a molecular weight of 198.31 g/mol, XLogP of 4.11, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-2,3-dimethylidene-1H-indene is sourced from PubChem (CID 58981235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).