1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene

C17H24 — CID 178141124

IUPAC1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene
SMILESC=C(c1ccc(CC(C)C)cc1)C1CCCC1
InChIInChI=1S/C17H24/c1-13(2)12-15-8-10-17(11-9-15)14(3)16-6-4-5-7-16/h8-11,13,16H,3-7,12H2,1-2H3
InChIKeyPCGCFPYYXJBXQE-UHFFFAOYSA-N
MW228.38 g/mol
LogP5.09
Rot. Bonds4

About 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene

1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene (PubChem CID 178141124) has the molecular formula C17H24 and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene.

Molecular Properties

Compound Name1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene
PubChem CID178141124
Molecular FormulaC17H24
Molecular Weight228.38 g/mol
Exact Mass228.19
IUPAC Name1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene
SMILESC=C(c1ccc(CC(C)C)cc1)C1CCCC1
InChIInChI=1S/C17H24/c1-13(2)12-15-8-10-17(11-9-15)14(3)16-6-4-5-7-16/h8-11,13,16H,3-7,12H2,1-2H3
InChIKeyPCGCFPYYXJBXQE-UHFFFAOYSA-N
XLogP5.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500228.38
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(2-methylpropyl)-4-prop-1-en-2-ylbenzene
CID 10176333
N'-(cyclohexanecarbonyl)-4-(2-methylpropyl)benzohydrazide
CID 8639719
ethane;1-(2-methylpropyl)-4-prop-1-en-2-ylbenzene
CID 144516269
N-[1-[4-(2-methylpropyl)phenyl]ethyl]cyclopentanecarboxamide
CID 112791720
N-[2-[4-(2-methylpropyl)phenyl]-2-oxoethyl]cyclopropanecarboxamide
CID 94272830
cyclopropyl-[4-[4-(2-methylpropyl)benzoyl]-1,4-diazepan-1-yl]methanone
CID 110806443
1-[4-(cyclopentanecarbonyl)piperazin-1-yl]-4-[4-(2-methylpropyl)phenyl]butane-1,4-dione
CID 55689728
[4-(2-methylpropyl)phenyl]-(oxan-4-yl)methanone
CID 62906178
cyclobutyl-[4-[4-(2-methylpropyl)benzoyl]-1,4-diazepan-1-yl]methanone
CID 110809297
4-[[4-(2-methylpropyl)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 166193453
1-(1-ethoxyethenyl)-4-(2-methylpropyl)benzene
CID 146686998
[4-(2-methylpropyl)phenyl]-pyrrolidin-2-ylmethanone
CID 64868969

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene?
The IUPAC name of 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene (CID 178141124) is 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene.
What is the SMILES notation for 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene?
The canonical SMILES for 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene is C=C(c1ccc(CC(C)C)cc1)C1CCCC1.
What is the InChIKey of 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene?
The InChIKey is PCGCFPYYXJBXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24/c1-13(2)12-15-8-10-17(11-9-15)14(3)16-6-4-5-7-16/h8-11,13,16H,3-7,12H2,1-2H3.
What are the key properties of 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene?
1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene has a molecular weight of 228.38 g/mol, XLogP of 5.09, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylethenyl)-4-(2-methylpropyl)benzene is sourced from PubChem (CID 178141124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).