1,1,2,3,3-pentamethyl-2H-indene

C14H20 — CID 14549

IUPAC1,1,2,3,3-pentamethyl-2H-indene
SMILESCC1C(C)(C)c2ccccc2C1(C)C
InChIInChI=1S/C14H20/c1-10-13(2,3)11-8-6-7-9-12(11)14(10,4)5/h6-10H,1-5H3
InChIKeyZCMKNGQFIXAHLP-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.89
Rot. Bonds

About 1,1,2,3,3-pentamethyl-2H-indene

1,1,2,3,3-pentamethyl-2H-indene (PubChem CID 14549) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is 1,1,2,3,3-pentamethyl-2H-indene.

Molecular Properties

Compound Name1,1,2,3,3-pentamethyl-2H-indene
PubChem CID14549
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name1,1,2,3,3-pentamethyl-2H-indene
SMILESCC1C(C)(C)c2ccccc2C1(C)C
InChIInChI=1S/C14H20/c1-10-13(2,3)11-8-6-7-9-12(11)14(10,4)5/h6-10H,1-5H3
InChIKeyZCMKNGQFIXAHLP-UHFFFAOYSA-N
XLogP3.89
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 ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,3-pentamethyl-2H-indene?
The IUPAC name of 1,1,2,3,3-pentamethyl-2H-indene (CID 14549) is 1,1,2,3,3-pentamethyl-2H-indene.
What is the SMILES notation for 1,1,2,3,3-pentamethyl-2H-indene?
The canonical SMILES for 1,1,2,3,3-pentamethyl-2H-indene is CC1C(C)(C)c2ccccc2C1(C)C.
What is the InChIKey of 1,1,2,3,3-pentamethyl-2H-indene?
The InChIKey is ZCMKNGQFIXAHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20/c1-10-13(2,3)11-8-6-7-9-12(11)14(10,4)5/h6-10H,1-5H3.
What are the key properties of 1,1,2,3,3-pentamethyl-2H-indene?
1,1,2,3,3-pentamethyl-2H-indene has a molecular weight of 188.31 g/mol, XLogP of 3.89, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,3-pentamethyl-2H-indene is sourced from PubChem (CID 14549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).