1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane

C11H20 — CID 123345724

IUPAC1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane
SMILESCC1CC(CC2CCC2C)C1
InChIInChI=1S/C11H20/c1-8-5-10(6-8)7-11-4-3-9(11)2/h8-11H,3-7H2,1-2H3
InChIKeyDDEIDJJHVIFTBX-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.47
Rot. Bonds2

About 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane

1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane (PubChem CID 123345724) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane.

Molecular Properties

Compound Name1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane
PubChem CID123345724
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane
SMILESCC1CC(CC2CCC2C)C1
InChIInChI=1S/C11H20/c1-8-5-10(6-8)7-11-4-3-9(11)2/h8-11H,3-7H2,1-2H3
InChIKeyDDEIDJJHVIFTBX-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane?
The IUPAC name of 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane (CID 123345724) is 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane.
What is the SMILES notation for 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane?
The canonical SMILES for 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane is CC1CC(CC2CCC2C)C1.
What is the InChIKey of 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane?
The InChIKey is DDEIDJJHVIFTBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-8-5-10(6-8)7-11-4-3-9(11)2/h8-11H,3-7H2,1-2H3.
What are the key properties of 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane?
1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane has a molecular weight of 152.28 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[(3-methylcyclobutyl)methyl]cyclobutane is sourced from PubChem (CID 123345724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).