2,2-dimethylpropane;1H-indene

C14H20 — CID 91444603

IUPAC2,2-dimethylpropane;1H-indene
SMILESC1=Cc2ccccc2C1.CC(C)(C)C
InChIInChI=1S/C9H8.C5H12/c1-2-5-9-7-3-6-8(9)4-1;1-5(2,3)4/h1-6H,7H2;1-4H3
InChIKeyTVVDJCOCLVGAII-UHFFFAOYSA-N
MW188.31 g/mol
LogP4.31
Rot. Bonds

About 2,2-dimethylpropane;1H-indene

2,2-dimethylpropane;1H-indene (PubChem CID 91444603) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 2,2-dimethylpropane;1H-indene.

Molecular Properties

Compound Name2,2-dimethylpropane;1H-indene
PubChem CID91444603
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name2,2-dimethylpropane;1H-indene
SMILESC1=Cc2ccccc2C1.CC(C)(C)C
InChIInChI=1S/C9H8.C5H12/c1-2-5-9-7-3-6-8(9)4-1;1-5(2,3)4/h1-6H,7H2;1-4H3
InChIKeyTVVDJCOCLVGAII-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bis(2,3-dihydro-1H-indene);hexakis(2,2-dimethylpropane);tetrakis(1H-indene)
CID 158590082
2,3-dihydro-1H-indene;bis(2,2-dimethylpropane);1H-indene;methane
CID 157086025
copper;1H-indene
CID 175216856
1H-indene;methane
CID 22114429
1H-indene;methane
CID 157370172
hydrogen peroxide;1H-indene;hydrobromide
CID 158452751
CID 67393892
CID 67393892
1,4-diphenylbenzene;1H-indene
CID 156634731
azulene;1H-indene
CID 160524105
1H-indene;pyrazine
CID 175286554
ethoxyethane;1H-indene
CID 86747629
1H-indene;phenol
CID 22398273

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropane;1H-indene?
The IUPAC name of 2,2-dimethylpropane;1H-indene (CID 91444603) is 2,2-dimethylpropane;1H-indene.
What is the SMILES notation for 2,2-dimethylpropane;1H-indene?
The canonical SMILES for 2,2-dimethylpropane;1H-indene is C1=Cc2ccccc2C1.CC(C)(C)C.
What is the InChIKey of 2,2-dimethylpropane;1H-indene?
The InChIKey is TVVDJCOCLVGAII-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8.C5H12/c1-2-5-9-7-3-6-8(9)4-1;1-5(2,3)4/h1-6H,7H2;1-4H3.
What are the key properties of 2,2-dimethylpropane;1H-indene?
2,2-dimethylpropane;1H-indene has a molecular weight of 188.31 g/mol, XLogP of 4.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropane;1H-indene is sourced from PubChem (CID 91444603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).