1-methyl-2,3-di(propan-2-ylidene)-1H-indene

C16H20 — CID 23521644

IUPAC1-methyl-2,3-di(propan-2-ylidene)-1H-indene
SMILESCC(C)=C1C(=C(C)C)C(C)c2ccccc21
InChIInChI=1S/C16H20/c1-10(2)15-12(5)13-8-6-7-9-14(13)16(15)11(3)4/h6-9,12H,1-5H3
InChIKeyWYOQBDMBULXUKX-UHFFFAOYSA-N
MW212.34 g/mol
LogP4.93
Rot. Bonds

About 1-methyl-2,3-di(propan-2-ylidene)-1H-indene

1-methyl-2,3-di(propan-2-ylidene)-1H-indene (PubChem CID 23521644) has the molecular formula C16H20 and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-methyl-2,3-di(propan-2-ylidene)-1H-indene.

Molecular Properties

Compound Name1-methyl-2,3-di(propan-2-ylidene)-1H-indene
PubChem CID23521644
Molecular FormulaC16H20
Molecular Weight212.34 g/mol
Exact Mass212.16
IUPAC Name1-methyl-2,3-di(propan-2-ylidene)-1H-indene
SMILESCC(C)=C1C(=C(C)C)C(C)c2ccccc21
InChIInChI=1S/C16H20/c1-10(2)15-12(5)13-8-6-7-9-14(13)16(15)11(3)4/h6-9,12H,1-5H3
InChIKeyWYOQBDMBULXUKX-UHFFFAOYSA-N
XLogP4.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2,3-di(propan-2-ylidene)-1H-indene?
The IUPAC name of 1-methyl-2,3-di(propan-2-ylidene)-1H-indene (CID 23521644) is 1-methyl-2,3-di(propan-2-ylidene)-1H-indene.
What is the SMILES notation for 1-methyl-2,3-di(propan-2-ylidene)-1H-indene?
The canonical SMILES for 1-methyl-2,3-di(propan-2-ylidene)-1H-indene is CC(C)=C1C(=C(C)C)C(C)c2ccccc21.
What is the InChIKey of 1-methyl-2,3-di(propan-2-ylidene)-1H-indene?
The InChIKey is WYOQBDMBULXUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20/c1-10(2)15-12(5)13-8-6-7-9-14(13)16(15)11(3)4/h6-9,12H,1-5H3.
What are the key properties of 1-methyl-2,3-di(propan-2-ylidene)-1H-indene?
1-methyl-2,3-di(propan-2-ylidene)-1H-indene has a molecular weight of 212.34 g/mol, XLogP of 4.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2,3-di(propan-2-ylidene)-1H-indene is sourced from PubChem (CID 23521644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).