1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane

C15H30 — CID 123699585

IUPAC1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane
SMILESCCC(C)C1CCCC1C(C)CC(C)C
InChIInChI=1S/C15H30/c1-6-12(4)14-8-7-9-15(14)13(5)10-11(2)3/h11-15H,6-10H2,1-5H3
InChIKeyPXPLSLMDVMLNNL-UHFFFAOYSA-N
MW210.40 g/mol
LogP5.13
Rot. Bonds5

About 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane

1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane (PubChem CID 123699585) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane.

Molecular Properties

Compound Name1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane
PubChem CID123699585
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane
SMILESCCC(C)C1CCCC1C(C)CC(C)C
InChIInChI=1S/C15H30/c1-6-12(4)14-8-7-9-15(14)13(5)10-11(2)3/h11-15H,6-10H2,1-5H3
InChIKeyPXPLSLMDVMLNNL-UHFFFAOYSA-N
XLogP5.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.40
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-butan-2-yl-2-pentan-3-ylcyclopentane
CID 123672278
1-[(2S)-butan-2-yl]-2-ethylcyclopentane
CID 146934548
1-butan-2-yl-2-ethylcyclopentane
CID 91358263
2-(4-methylpentan-2-yl)cyclohexan-1-amine
CID 16727057
ethane;4-methylpentan-2-ylcyclobutane
CID 158871771
1-methyl-2-(4-methylhexan-2-yl)cyclopentane
CID 123800434
trans-(1R,2S)-2-butan-2-ylcyclohexan-1-amine
CID 22853538
2-butan-2-ylcycloheptan-1-ol
CID 23148884
1-butan-2-yl-2-(3-methylbutan-2-yl)cyclobutane
CID 90723847
[(1S,2S)-2-butan-2-ylcyclohexyl]methanamine
CID 167231134
2-methylbutane;methylcyclobutane
CID 57473841
1-butan-2-yl-2-methylcyclohexane;hexane
CID 143477075

Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane?
The IUPAC name of 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane (CID 123699585) is 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane.
What is the SMILES notation for 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane?
The canonical SMILES for 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane is CCC(C)C1CCCC1C(C)CC(C)C.
What is the InChIKey of 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane?
The InChIKey is PXPLSLMDVMLNNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-6-12(4)14-8-7-9-15(14)13(5)10-11(2)3/h11-15H,6-10H2,1-5H3.
What are the key properties of 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane?
1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane has a molecular weight of 210.40 g/mol, XLogP of 5.13, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-2-(4-methylpentan-2-yl)cyclopentane is sourced from PubChem (CID 123699585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).