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

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(9S,18S,27S)-9,18,27-trimethylheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 101264087
9-methyl-9H-fluorene;prop-1-ene
CID 145012304
9-methyl-9H-fluorene-1,2,3,4-tetrol
CID 163845357
16-propan-2-ylidenetetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaen-15-one
CID 102428208
2-propan-2-ylidenetricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene
CID 14290121
1,9-dimethyl-9H-fluorene
CID 28227
1-methyl-3-phenyl-1H-indene-2-carboxylic acid
CID 177461610
2-(2,3-dimethyl-3H-inden-1-yl)ethanol
CID 19910541
9-deuterio-9-methylfluorene
CID 169301704
ethane;propane;1,2,3-trimethyl-1H-indene
CID 142448762
9-but-2-en-2-yl-9H-fluorene
CID 58635963
3-fluoro-1-methyl-2-phenyl-1H-indene
CID 86003078

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).