5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene

C14H24 — CID 87360784

IUPAC5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene
SMILESCCC(C)(C1=CC(C)C=C1)C(C)(C)C
InChIInChI=1S/C14H24/c1-7-14(6,13(3,4)5)12-9-8-11(2)10-12/h8-11H,7H2,1-6H3
InChIKeyWDCPJFKIEHZXHG-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.58
Rot. Bonds2

About 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene

5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene (PubChem CID 87360784) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene.

Molecular Properties

Compound Name5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene
PubChem CID87360784
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene
SMILESCCC(C)(C1=CC(C)C=C1)C(C)(C)C
InChIInChI=1S/C14H24/c1-7-14(6,13(3,4)5)12-9-8-11(2)10-12/h8-11H,7H2,1-6H3
InChIKeyWDCPJFKIEHZXHG-UHFFFAOYSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-iodo-3-(3-methylcyclopenta-1,4-dien-1-yl)but-1-en-2-amine
CID 167092125
2,5-bis(2,2,3-trimethylpentan-3-yl)thiophene
CID 134401951
CID 174083198
CID 174083198
2-butyl-5-methylcyclopenta-1,3-diene;zirconium
CID 174290613
2-butyl-5-methylcyclopenta-1,3-diene;hafnium
CID 174884437
2,3-dimethyl-3-[5-(2,2,3-trimethylpentan-3-yl)thiophen-2-yl]pentane-2-thiol
CID 134401949
ethyl 2,2-difluoro-2-(3-methylcyclohepta-1,4,6-trien-1-yl)acetate
CID 143545774
4-tert-butyl-6-methyl-N-propylcyclohexa-2,4-dien-1-amine
CID 155242464
bis(2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene);zirconium(2+);dihydrochloride
CID 174241252
2,6-dimethyl-2,6-dihydroanthracene
CID 58792602
2-butyl-5-methylcyclopenta-1,3-diene;dichlorotitanium
CID 174487779
2-butyl-5-methylcyclopenta-1,3-diene;difluorozirconium
CID 174700660

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene?
The IUPAC name of 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene (CID 87360784) is 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene.
What is the SMILES notation for 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene?
The canonical SMILES for 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene is CCC(C)(C1=CC(C)C=C1)C(C)(C)C.
What is the InChIKey of 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene?
The InChIKey is WDCPJFKIEHZXHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-7-14(6,13(3,4)5)12-9-8-11(2)10-12/h8-11H,7H2,1-6H3.
What are the key properties of 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene?
5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene has a molecular weight of 192.35 g/mol, XLogP of 4.58, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2,2,3-trimethylpentan-3-yl)cyclopenta-1,3-diene is sourced from PubChem (CID 87360784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).