1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene

C15H18 — CID 168819329

IUPAC1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene
SMILESCc1ccc(C2C=CC=C2)c(C(C)C)c1
InChIInChI=1S/C15H18/c1-11(2)15-10-12(3)8-9-14(15)13-6-4-5-7-13/h4-11,13H,1-3H3
InChIKeySABDRTUKOXIUPY-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.33
Rot. Bonds2

About 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene

1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene (PubChem CID 168819329) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene.

Molecular Properties

Compound Name1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene
PubChem CID168819329
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene
SMILESCc1ccc(C2C=CC=C2)c(C(C)C)c1
InChIInChI=1S/C15H18/c1-11(2)15-10-12(3)8-9-14(15)13-6-4-5-7-13/h4-11,13H,1-3H3
InChIKeySABDRTUKOXIUPY-UHFFFAOYSA-N
XLogP4.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-methyl-1-(4-methyl-2-propan-2-ylphenyl)-2-propan-2-ylbenzene
CID 20697925
methyl-bis(4-methyl-2-propan-2-ylphenyl)bismuthane
CID 164733383
4-methyl-1-(4-methyl-2-propan-2-ylphenyl)sulfanyl-2-propan-2-ylbenzene
CID 156775921
2,4-dimethyl-1-(4-methyl-2-propan-2-ylphenyl)benzene
CID 18730157
4-methyl-1-(4-methyl-2-propan-2-ylphenyl)sulfonyl-2-propan-2-ylbenzene
CID 54063332
(4-methyl-2-propan-2-ylphenyl)hydrazine
CID 169152361
1-benzyl-4-methyl-2-propan-2-ylbenzene
CID 59400391
ethane;5-methyl-2-propan-2-ylaniline
CID 142850696
potassium 5-methyl-2-propan-2-ylphenolate
CID 23693969
bis(5-methyl-2-propan-2-ylphenol);dihydroiodide
CID 69164517
cobalt;bis(5-methyl-2-propan-2-ylphenol)
CID 156896903
5-methyl-2-propan-2-ylphenol;zinc
CID 160855786

Frequently Asked Questions

What is the IUPAC name of 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene?
The IUPAC name of 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene (CID 168819329) is 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene.
What is the SMILES notation for 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene?
The canonical SMILES for 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene is Cc1ccc(C2C=CC=C2)c(C(C)C)c1.
What is the InChIKey of 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene?
The InChIKey is SABDRTUKOXIUPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-11(2)15-10-12(3)8-9-14(15)13-6-4-5-7-13/h4-11,13H,1-3H3.
What are the key properties of 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene?
1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene has a molecular weight of 198.31 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopenta-2,4-dien-1-yl-4-methyl-2-propan-2-ylbenzene is sourced from PubChem (CID 168819329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).