2,2,3,3-tetramethyl-1-propyl-1H-indene

C16H24 — CID 54246995

IUPAC2,2,3,3-tetramethyl-1-propyl-1H-indene
SMILESCCCC1c2ccccc2C(C)(C)C1(C)C
InChIInChI=1S/C16H24/c1-6-9-13-12-10-7-8-11-14(12)16(4,5)15(13,2)3/h7-8,10-11,13H,6,9H2,1-5H3
InChIKeyQTYRZWOSQHTNQC-UHFFFAOYSA-N
MW216.37 g/mol
LogP4.89
Rot. Bonds2

About 2,2,3,3-tetramethyl-1-propyl-1H-indene

2,2,3,3-tetramethyl-1-propyl-1H-indene (PubChem CID 54246995) has the molecular formula C16H24 and a molecular weight of 216.37 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-1-propyl-1H-indene.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-1-propyl-1H-indene
PubChem CID54246995
Molecular FormulaC16H24
Molecular Weight216.37 g/mol
Exact Mass216.19
IUPAC Name2,2,3,3-tetramethyl-1-propyl-1H-indene
SMILESCCCC1c2ccccc2C(C)(C)C1(C)C
InChIInChI=1S/C16H24/c1-6-9-13-12-10-7-8-11-14(12)16(4,5)15(13,2)3/h7-8,10-11,13H,6,9H2,1-5H3
InChIKeyQTYRZWOSQHTNQC-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-1-propyl-1H-indene?
The IUPAC name of 2,2,3,3-tetramethyl-1-propyl-1H-indene (CID 54246995) is 2,2,3,3-tetramethyl-1-propyl-1H-indene.
What is the SMILES notation for 2,2,3,3-tetramethyl-1-propyl-1H-indene?
The canonical SMILES for 2,2,3,3-tetramethyl-1-propyl-1H-indene is CCCC1c2ccccc2C(C)(C)C1(C)C.
What is the InChIKey of 2,2,3,3-tetramethyl-1-propyl-1H-indene?
The InChIKey is QTYRZWOSQHTNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24/c1-6-9-13-12-10-7-8-11-14(12)16(4,5)15(13,2)3/h7-8,10-11,13H,6,9H2,1-5H3.
What are the key properties of 2,2,3,3-tetramethyl-1-propyl-1H-indene?
2,2,3,3-tetramethyl-1-propyl-1H-indene has a molecular weight of 216.37 g/mol, XLogP of 4.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-1-propyl-1H-indene is sourced from PubChem (CID 54246995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).