2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene

C14H18 — CID 157161227

IUPAC2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene
SMILESCC1=C(c2ccc(C)cc2C)CCC1
InChIInChI=1S/C14H18/c1-10-7-8-14(12(3)9-10)13-6-4-5-11(13)2/h7-9H,4-6H2,1-3H3
InChIKeyZEDXWENCXRTNNJ-UHFFFAOYSA-N
MW186.30 g/mol
LogP4.26
Rot. Bonds1

About 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene

2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene (PubChem CID 157161227) has the molecular formula C14H18 and a molecular weight of 186.30 g/mol. Its IUPAC name is 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene.

Molecular Properties

Compound Name2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene
PubChem CID157161227
Molecular FormulaC14H18
Molecular Weight186.30 g/mol
Exact Mass186.14
IUPAC Name2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene
SMILESCC1=C(c2ccc(C)cc2C)CCC1
InChIInChI=1S/C14H18/c1-10-7-8-14(12(3)9-10)13-6-4-5-11(13)2/h7-9H,4-6H2,1-3H3
InChIKeyZEDXWENCXRTNNJ-UHFFFAOYSA-N
XLogP4.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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5,13-dimethyltricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaene
CID 23561339
3-(2,4-dimethylphenyl)cyclohex-2-en-1-one
CID 23529827
2,5-bis(2,4-dimethylphenyl)furan
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CID 107382852
2-(2,4-dimethylphenyl)cyclohex-2-en-1-one
CID 130517989
2-(2,4-dimethylphenyl)-1-propan-2-yl-6,7-dihydro-5H-indol-4-one
CID 59052499
2,7-dimethyl-9,10-dihydrophenanthrene
CID 23550290
2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene
CID 20697245
1-[3-(2,4-dimethylphenyl)phenyl]-2,4-dimethylbenzene
CID 90996196
6-(2,4-dimethylphenyl)-5-(3-hydroxyphenyl)-8,9-dihydro-7H-benzo[7]annulene-2-carboxylic acid
CID 176863851

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene?
The IUPAC name of 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene (CID 157161227) is 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene.
What is the SMILES notation for 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene?
The canonical SMILES for 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene is CC1=C(c2ccc(C)cc2C)CCC1.
What is the InChIKey of 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene?
The InChIKey is ZEDXWENCXRTNNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18/c1-10-7-8-14(12(3)9-10)13-6-4-5-11(13)2/h7-9H,4-6H2,1-3H3.
What are the key properties of 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene?
2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene has a molecular weight of 186.30 g/mol, XLogP of 4.26, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1-(2-methylcyclopenten-1-yl)benzene is sourced from PubChem (CID 157161227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).