1-cyclopropyl-1-methylcyclopropane

C7H12 — CID 12950123

IUPAC1-cyclopropyl-1-methylcyclopropane
SMILESCC1(C2CC2)CC1
InChIInChI=1S/C7H12/c1-7(4-5-7)6-2-3-6/h6H,2-5H2,1H3
InChIKeyVXMROXWXBFKQGY-UHFFFAOYSA-N
MW96.17 g/mol
LogP2.20
Rot. Bonds1

About 1-cyclopropyl-1-methylcyclopropane

1-cyclopropyl-1-methylcyclopropane (PubChem CID 12950123) has the molecular formula C7H12 and a molecular weight of 96.17 g/mol. Its IUPAC name is 1-cyclopropyl-1-methylcyclopropane.

Molecular Properties

Compound Name1-cyclopropyl-1-methylcyclopropane
PubChem CID12950123
Molecular FormulaC7H12
Molecular Weight96.17 g/mol
Exact Mass96.09
IUPAC Name1-cyclopropyl-1-methylcyclopropane
SMILESCC1(C2CC2)CC1
InChIInChI=1S/C7H12/c1-7(4-5-7)6-2-3-6/h6H,2-5H2,1H3
InChIKeyVXMROXWXBFKQGY-UHFFFAOYSA-N
XLogP2.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.17
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-methylcyclopropane?
The IUPAC name of 1-cyclopropyl-1-methylcyclopropane (CID 12950123) is 1-cyclopropyl-1-methylcyclopropane.
What is the SMILES notation for 1-cyclopropyl-1-methylcyclopropane?
The canonical SMILES for 1-cyclopropyl-1-methylcyclopropane is CC1(C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-1-methylcyclopropane?
The InChIKey is VXMROXWXBFKQGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12/c1-7(4-5-7)6-2-3-6/h6H,2-5H2,1H3.
What are the key properties of 1-cyclopropyl-1-methylcyclopropane?
1-cyclopropyl-1-methylcyclopropane has a molecular weight of 96.17 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-methylcyclopropane is sourced from PubChem (CID 12950123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).