1,2-dimethylcyclobutane;2-methylpropane

C10H22 — CID 143728444

IUPAC1,2-dimethylcyclobutane;2-methylpropane
SMILESCC(C)C.CC1CCC1C
InChIInChI=1S/C6H12.C4H10/c1-5-3-4-6(5)2;1-4(2)3/h5-6H,3-4H2,1-2H3;4H,1-3H3
InChIKeyLEKZOIXTSYCBNS-UHFFFAOYSA-N
MW142.29 g/mol
LogP3.71
Rot. Bonds

About 1,2-dimethylcyclobutane;2-methylpropane

1,2-dimethylcyclobutane;2-methylpropane (PubChem CID 143728444) has the molecular formula C10H22 and a molecular weight of 142.29 g/mol. Its IUPAC name is 1,2-dimethylcyclobutane;2-methylpropane.

Molecular Properties

Compound Name1,2-dimethylcyclobutane;2-methylpropane
PubChem CID143728444
Molecular FormulaC10H22
Molecular Weight142.29 g/mol
Exact Mass142.17
IUPAC Name1,2-dimethylcyclobutane;2-methylpropane
SMILESCC(C)C.CC1CCC1C
InChIInChI=1S/C6H12.C4H10/c1-5-3-4-6(5)2;1-4(2)3/h5-6H,3-4H2,1-2H3;4H,1-3H3
InChIKeyLEKZOIXTSYCBNS-UHFFFAOYSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.29
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylcyclobutane;2-methylpropane?
The IUPAC name of 1,2-dimethylcyclobutane;2-methylpropane (CID 143728444) is 1,2-dimethylcyclobutane;2-methylpropane.
What is the SMILES notation for 1,2-dimethylcyclobutane;2-methylpropane?
The canonical SMILES for 1,2-dimethylcyclobutane;2-methylpropane is CC(C)C.CC1CCC1C.
What is the InChIKey of 1,2-dimethylcyclobutane;2-methylpropane?
The InChIKey is LEKZOIXTSYCBNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.C4H10/c1-5-3-4-6(5)2;1-4(2)3/h5-6H,3-4H2,1-2H3;4H,1-3H3.
What are the key properties of 1,2-dimethylcyclobutane;2-methylpropane?
1,2-dimethylcyclobutane;2-methylpropane has a molecular weight of 142.29 g/mol, XLogP of 3.71, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylcyclobutane;2-methylpropane is sourced from PubChem (CID 143728444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).