methylcyclopentane

C6H12 — CID 7296

IUPACmethylcyclopentane
SMILESCC1CCCC1
InChIInChI=1S/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H3
InChIKeyGDOPTJXRTPNYNR-UHFFFAOYSA-N
MW84.16 g/mol
LogP2.20
Rot. Bonds

About methylcyclopentane

methylcyclopentane (PubChem CID 7296) has the molecular formula C6H12 and a molecular weight of 84.16 g/mol. Its IUPAC name is methylcyclopentane.

Molecular Properties

Compound Namemethylcyclopentane
PubChem CID7296
Molecular FormulaC6H12
Molecular Weight84.16 g/mol
Exact Mass84.09
IUPAC Namemethylcyclopentane
SMILESCC1CCCC1
InChIInChI=1S/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H3
InChIKeyGDOPTJXRTPNYNR-UHFFFAOYSA-N
XLogP2.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.16
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

erbium;tris(methylcyclopentane)
CID 91996115
CID 158187464
CID 158187464
cyclohexane;methylcyclopentane
CID 20788572
1,6-dimethylcycloundecane
CID 91298161
methylcyclobutane;tetrakis(methylcyclopentane)
CID 160836928
ethane;methylcyclohexane;methylcyclopentane
CID 159395989
methane;methylcyclohexane
CID 143705611
gallane;methylcyclohexane
CID 174461507
1,5,9,13,17,21-hexamethylcyclotetracosane
CID 164675975
ethane;methylcyclohexane;dihydrate
CID 144526565
ethane;methane;methylcyclohexane;methylcyclopentane
CID 158993326
methylcyclohexane;phosphane;pentahydrochloride
CID 174057866

Frequently Asked Questions

What is the IUPAC name of methylcyclopentane?
The IUPAC name of methylcyclopentane (CID 7296) is methylcyclopentane.
What is the SMILES notation for methylcyclopentane?
The canonical SMILES for methylcyclopentane is CC1CCCC1.
What is the InChIKey of methylcyclopentane?
The InChIKey is GDOPTJXRTPNYNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H3.
What are the key properties of methylcyclopentane?
methylcyclopentane has a molecular weight of 84.16 g/mol, XLogP of 2.20, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methylcyclopentane is sourced from PubChem (CID 7296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).