2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene

C13H14 — CID 59090525

IUPAC2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene
SMILESCC1=Cc2c(C)c3c(c(C)c2C1)C3
InChIInChI=1S/C13H14/c1-7-4-10-8(2)12-6-13(12)9(3)11(10)5-7/h4H,5-6H2,1-3H3
InChIKeyUSUDWQSUNJDVKC-UHFFFAOYSA-N
MW170.25 g/mol
LogP3.17
Rot. Bonds

About 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene

2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene (PubChem CID 59090525) has the molecular formula C13H14 and a molecular weight of 170.25 g/mol. Its IUPAC name is 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene.

Molecular Properties

Compound Name2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene
PubChem CID59090525
Molecular FormulaC13H14
Molecular Weight170.25 g/mol
Exact Mass170.11
IUPAC Name2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene
SMILESCC1=Cc2c(C)c3c(c(C)c2C1)C3
InChIInChI=1S/C13H14/c1-7-4-10-8(2)12-6-13(12)9(3)11(10)5-7/h4H,5-6H2,1-3H3
InChIKeyUSUDWQSUNJDVKC-UHFFFAOYSA-N
XLogP3.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene?
The IUPAC name of 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene (CID 59090525) is 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene.
What is the SMILES notation for 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene?
The canonical SMILES for 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene is CC1=Cc2c(C)c3c(c(C)c2C1)C3.
What is the InChIKey of 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene?
The InChIKey is USUDWQSUNJDVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14/c1-7-4-10-8(2)12-6-13(12)9(3)11(10)5-7/h4H,5-6H2,1-3H3.
What are the key properties of 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene?
2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene has a molecular weight of 170.25 g/mol, XLogP of 3.17, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethyl-1,5-dihydrocyclopropa[f]indene is sourced from PubChem (CID 59090525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).