2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene

C13H20 — CID 87359254

IUPAC2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene
SMILESCC(C)C1(C2=CCC=C2)CCCC1
InChIInChI=1S/C13H20/c1-11(2)13(9-5-6-10-13)12-7-3-4-8-12/h3,7-8,11H,4-6,9-10H2,1-2H3
InChIKeyLYWJZTMYZUJHCF-UHFFFAOYSA-N
MW176.30 g/mol
LogP4.09
Rot. Bonds2

About 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene

2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene (PubChem CID 87359254) has the molecular formula C13H20 and a molecular weight of 176.30 g/mol. Its IUPAC name is 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene.

Molecular Properties

Compound Name2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene
PubChem CID87359254
Molecular FormulaC13H20
Molecular Weight176.30 g/mol
Exact Mass176.16
IUPAC Name2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene
SMILESCC(C)C1(C2=CCC=C2)CCCC1
InChIInChI=1S/C13H20/c1-11(2)13(9-5-6-10-13)12-7-3-4-8-12/h3,7-8,11H,4-6,9-10H2,1-2H3
InChIKeyLYWJZTMYZUJHCF-UHFFFAOYSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-cyclopenta-1,4-dien-1-ylcyclopropan-1-ol
CID 163697301
1-cyclopenta-1,4-dien-1-yl-1-propan-2-ylindene
CID 19977332
ethane;2-[1-[(3E)-hexa-1,3,5-trien-3-yl]cyclopentyl]cyclopenta-1,3-diene
CID 145055342
2-[3-(2,3-dimethylbutan-2-yl)-1-methylcyclopentyl]cyclopenta-1,3-diene
CID 87360385
hafnium;2-propan-2-ylcyclopenta-1,3-diene
CID 175311105
2-(1-ethylsulfanylethyl)cyclopenta-1,3-diene
CID 22555230
3-(4-bromophenyl)-3-propan-2-ylpyrrolidine
CID 83902900
CID 173141588
CID 173141588
[(1R)-1-cyclopenta-1,4-dien-1-ylethyl]-trimethylazanium
CID 137225477
14-cyclopenta-1,4-dien-1-yl-13,15-dioxa-14-boradispiro[5.0.57.36]pentadecane
CID 135556141
molecular hydrogen;propane;1-[4-(1-propan-2-ylcyclopropyl)phenyl]cyclopropan-1-amine
CID 144873811
1-(1-propan-2-ylcyclohexyl)naphthalene
CID 57087987

Frequently Asked Questions

What is the IUPAC name of 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene?
The IUPAC name of 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene (CID 87359254) is 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene.
What is the SMILES notation for 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene?
The canonical SMILES for 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene is CC(C)C1(C2=CCC=C2)CCCC1.
What is the InChIKey of 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene?
The InChIKey is LYWJZTMYZUJHCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20/c1-11(2)13(9-5-6-10-13)12-7-3-4-8-12/h3,7-8,11H,4-6,9-10H2,1-2H3.
What are the key properties of 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene?
2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene has a molecular weight of 176.30 g/mol, XLogP of 4.09, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propan-2-ylcyclopentyl)cyclopenta-1,3-diene is sourced from PubChem (CID 87359254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).