1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene

C15H18 — CID 147554829

IUPAC1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene
SMILESCC(C)Cc1ccc(C2=CCC=C2)cc1
InChIInChI=1S/C15H18/c1-12(2)11-13-7-9-15(10-8-13)14-5-3-4-6-14/h3,5-10,12H,4,11H2,1-2H3
InChIKeyFRLZTHALWQNKFC-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.23
Rot. Bonds3

About 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene

1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene (PubChem CID 147554829) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene.

Molecular Properties

Compound Name1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene
PubChem CID147554829
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene
SMILESCC(C)Cc1ccc(C2=CCC=C2)cc1
InChIInChI=1S/C15H18/c1-12(2)11-13-7-9-15(10-8-13)14-5-3-4-6-14/h3,5-10,12H,4,11H2,1-2H3
InChIKeyFRLZTHALWQNKFC-UHFFFAOYSA-N
XLogP4.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-chloro-2-[4-(2-methylpropyl)phenyl]benzene;bis(1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene);tris(1-methyl-3-[4-(2-methylpropyl)phenyl]benzene);bis(1-methyl-4-[4-(2-methylpropyl)phenyl]benzene);1-(2-methylpropyl)-4-phenylbenzene
CID 159298601
1-tert-butyl-4-cyclopenta-1,4-dien-1-ylbenzene
CID 19103892
N-methyl-4-[4-(2-methylpropyl)phenyl]aniline
CID 116962445
1-[[4-(2-methylpropyl)phenyl]methyl]cyclopropan-1-amine
CID 116932038
1-(methoxymethyl)-4-[4-(2-methylpropyl)phenyl]benzene
CID 149288523
1-(2-methylpropyl)-4-[1-[4-(2-methylpropyl)phenyl]ethyl]benzene
CID 11044622
[4-(2-methylpropyl)phenyl]methylphosphane
CID 69020974
1-(2-methylpropyl)-4-[4-(2-methylpropyl)phenyl]sulfinylbenzene
CID 139793494
methanidyl-[[4-(2-methylpropyl)phenyl]methyl]azanium
CID 89077917
4-[2-methyl-3-[4-(2-methylpropyl)phenyl]propyl]phenol
CID 166697370
1-cyclohexa-1,5-dien-1-yl-4-(iodomethyl)benzene
CID 70308724
ethane;4-(2-methylpropyl)benzenethiol
CID 143751683

Frequently Asked Questions

What is the IUPAC name of 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene?
The IUPAC name of 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene (CID 147554829) is 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene.
What is the SMILES notation for 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene?
The canonical SMILES for 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene is CC(C)Cc1ccc(C2=CCC=C2)cc1.
What is the InChIKey of 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene?
The InChIKey is FRLZTHALWQNKFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-12(2)11-13-7-9-15(10-8-13)14-5-3-4-6-14/h3,5-10,12H,4,11H2,1-2H3.
What are the key properties of 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene?
1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene has a molecular weight of 198.31 g/mol, XLogP of 4.23, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopenta-1,4-dien-1-yl-4-(2-methylpropyl)benzene is sourced from PubChem (CID 147554829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).