butane;methylcyclopentane

C10H22 — CID 142053859

IUPACbutane;methylcyclopentane
SMILESCC1CCCC1.CCCC
InChIInChI=1S/C6H12.C4H10/c1-6-4-2-3-5-6;1-3-4-2/h6H,2-5H2,1H3;3-4H2,1-2H3
InChIKeyWPXAGUHEJISZJM-UHFFFAOYSA-N
MW142.29 g/mol
LogP4.00
Rot. Bonds1

About butane;methylcyclopentane

butane;methylcyclopentane (PubChem CID 142053859) has the molecular formula C10H22 and a molecular weight of 142.29 g/mol. Its IUPAC name is butane;methylcyclopentane.

Molecular Properties

Compound Namebutane;methylcyclopentane
PubChem CID142053859
Molecular FormulaC10H22
Molecular Weight142.29 g/mol
Exact Mass142.17
IUPAC Namebutane;methylcyclopentane
SMILESCC1CCCC1.CCCC
InChIInChI=1S/C6H12.C4H10/c1-6-4-2-3-5-6;1-3-4-2/h6H,2-5H2,1H3;3-4H2,1-2H3
InChIKeyWPXAGUHEJISZJM-UHFFFAOYSA-N
XLogP4.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.29
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

butane;methanamine;methylcyclopentane
CID 142104572
butane;bis(hexane);bis(methylcyclopentane)
CID 162195101
ethane;methylcyclopentane;propane
CID 142080084
methylcyclopentane
CID 7296
methane;methylcyclohexane;propane
CID 143031585
ethene;methylcyclopentane;propane
CID 143370211
erbium;tris(methylcyclopentane)
CID 91996115
cyclohexane;methylcyclopentane
CID 20788572
CID 158187464
CID 158187464
1,6-dimethylcycloundecane
CID 91298161
methylcyclobutane;tetrakis(methylcyclopentane)
CID 160836928
ethane;methanethiol;bis(methylcyclopentane);propane
CID 162283921

Frequently Asked Questions

What is the IUPAC name of butane;methylcyclopentane?
The IUPAC name of butane;methylcyclopentane (CID 142053859) is butane;methylcyclopentane.
What is the SMILES notation for butane;methylcyclopentane?
The canonical SMILES for butane;methylcyclopentane is CC1CCCC1.CCCC.
What is the InChIKey of butane;methylcyclopentane?
The InChIKey is WPXAGUHEJISZJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.C4H10/c1-6-4-2-3-5-6;1-3-4-2/h6H,2-5H2,1H3;3-4H2,1-2H3.
What are the key properties of butane;methylcyclopentane?
butane;methylcyclopentane has a molecular weight of 142.29 g/mol, XLogP of 4.00, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;methylcyclopentane is sourced from PubChem (CID 142053859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).