1-tert-butyl-2-cyclopentylcyclopentane

C14H26 — CID 58689261

IUPAC1-tert-butyl-2-cyclopentylcyclopentane
SMILESCC(C)(C)C1CCCC1C1CCCC1
InChIInChI=1S/C14H26/c1-14(2,3)13-10-6-9-12(13)11-7-4-5-8-11/h11-13H,4-10H2,1-3H3
InChIKeyFKWOPHMYAQUBEO-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.64
Rot. Bonds1

About 1-tert-butyl-2-cyclopentylcyclopentane

1-tert-butyl-2-cyclopentylcyclopentane (PubChem CID 58689261) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 1-tert-butyl-2-cyclopentylcyclopentane.

Molecular Properties

Compound Name1-tert-butyl-2-cyclopentylcyclopentane
PubChem CID58689261
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name1-tert-butyl-2-cyclopentylcyclopentane
SMILESCC(C)(C)C1CCCC1C1CCCC1
InChIInChI=1S/C14H26/c1-14(2,3)13-10-6-9-12(13)11-7-4-5-8-11/h11-13H,4-10H2,1-3H3
InChIKeyFKWOPHMYAQUBEO-UHFFFAOYSA-N
XLogP4.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-tert-butyl-1,2,3,3a,4,5,6,7,8,8a-decahydroazulene;2-tert-butyl-1,2,3,3a,4,5,6,7,8,8a-decahydroazulene;4-tert-butyl-1,2,3,3a,4,5,6,7,8,8a-decahydroazulene;5-tert-butyl-1,2,3,3a,4,5,6,7,8,8a-decahydroazulene;6-tert-butyl-1,2,3,3a,4,5,6,7,8,8a-decahydroazulene;5-tert-butyl-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene;6-tert-butyl-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene;7-tert-butyl-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 158093658
1-tert-butyl-1,2,3,3a,4,5,6,6a-octahydropentalene;4-tert-butylcyclohexene
CID 167642052
4-tert-butyl-3-cyclopentylpiperidine
CID 112570800
1-tert-butyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;1-tert-butylcyclohexene
CID 167559321
1-[2-methyl-1-(4-methylcyclohexyl)propan-2-yl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 173085901
1,2-ditert-butylcyclobutane;1,2-ditert-butylcycloheptane;1,2-ditert-butylcyclohexane;1,2-ditert-butylcyclopentane;1,2-ditert-butylcyclopropane
CID 161041308
1-tert-butyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;1-tert-butyl-1,2,3,3a,4,5,6,6a-octahydropentalene;undecakis(tert-butylcycloheptane);tetrakis(tert-butylcyclohexane);tert-butylcyclopentane;2,2,3-trimethyloctane
CID 160724082
CID 174147625
CID 174147625
3-[2-(2,3,3a,4,5,5a,6,7,8,9,9a,9b-dodecahydro-1H-cyclopenta[a]naphthalen-3-yl)propan-2-yl]-2,3,3a,4,5,5a,6,7,8,9,9a,9b-dodecahydro-1H-cyclopenta[a]naphthalene
CID 91521883
1,2-ditert-butylcyclobutane;1,2-ditert-butylcyclohexane;1,3-ditert-butylcyclohexane;1,2-ditert-butylcyclopentane;1,2-ditert-butylcyclopropane
CID 161413124
1-cyclobutyl-2-methylcyclohexane
CID 146763407
(1S,4aR,8aR)-1-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 6427449

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-2-cyclopentylcyclopentane?
The IUPAC name of 1-tert-butyl-2-cyclopentylcyclopentane (CID 58689261) is 1-tert-butyl-2-cyclopentylcyclopentane.
What is the SMILES notation for 1-tert-butyl-2-cyclopentylcyclopentane?
The canonical SMILES for 1-tert-butyl-2-cyclopentylcyclopentane is CC(C)(C)C1CCCC1C1CCCC1.
What is the InChIKey of 1-tert-butyl-2-cyclopentylcyclopentane?
The InChIKey is FKWOPHMYAQUBEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-14(2,3)13-10-6-9-12(13)11-7-4-5-8-11/h11-13H,4-10H2,1-3H3.
What are the key properties of 1-tert-butyl-2-cyclopentylcyclopentane?
1-tert-butyl-2-cyclopentylcyclopentane has a molecular weight of 194.36 g/mol, XLogP of 4.64, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-2-cyclopentylcyclopentane is sourced from PubChem (CID 58689261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).