1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane

C12H22 — CID 58932440

IUPAC1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane
SMILESCC(C)C1(C2(C(C)C)CC2)CC1
InChIInChI=1S/C12H22/c1-9(2)11(5-6-11)12(7-8-12)10(3)4/h9-10H,5-8H2,1-4H3
InChIKeyUULZUDFEHJPBIY-UHFFFAOYSA-N
MW166.31 g/mol
LogP3.86
Rot. Bonds3

About 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane

1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane (PubChem CID 58932440) has the molecular formula C12H22 and a molecular weight of 166.31 g/mol. Its IUPAC name is 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane.

Molecular Properties

Compound Name1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane
PubChem CID58932440
Molecular FormulaC12H22
Molecular Weight166.31 g/mol
Exact Mass166.17
IUPAC Name1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane
SMILESCC(C)C1(C2(C(C)C)CC2)CC1
InChIInChI=1S/C12H22/c1-9(2)11(5-6-11)12(7-8-12)10(3)4/h9-10H,5-8H2,1-4H3
InChIKeyUULZUDFEHJPBIY-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.31
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane?
The IUPAC name of 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane (CID 58932440) is 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane.
What is the SMILES notation for 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane?
The canonical SMILES for 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane is CC(C)C1(C2(C(C)C)CC2)CC1.
What is the InChIKey of 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane?
The InChIKey is UULZUDFEHJPBIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22/c1-9(2)11(5-6-11)12(7-8-12)10(3)4/h9-10H,5-8H2,1-4H3.
What are the key properties of 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane?
1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane has a molecular weight of 166.31 g/mol, XLogP of 3.86, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-1-(1-propan-2-ylcyclopropyl)cyclopropane is sourced from PubChem (CID 58932440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).