1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane

C11H22 — CID 91220382

IUPAC1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane
SMILESCC(C)CC1(C)CC(C)C1C
InChIInChI=1S/C11H22/c1-8(2)6-11(5)7-9(3)10(11)4/h8-10H,6-7H2,1-5H3
InChIKeyYNRSRBONVZQTAM-UHFFFAOYSA-N
MW154.30 g/mol
LogP3.71
Rot. Bonds2

About 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane

1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane (PubChem CID 91220382) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane.

Molecular Properties

Compound Name1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane
PubChem CID91220382
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane
SMILESCC(C)CC1(C)CC(C)C1C
InChIInChI=1S/C11H22/c1-8(2)6-11(5)7-9(3)10(11)4/h8-10H,6-7H2,1-5H3
InChIKeyYNRSRBONVZQTAM-UHFFFAOYSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-Butyl-1-methyl-2-propylcyclopropane
CID 39066
1,2-Diethylcyclobutane
CID 43552
tert-Butylcyclohexane
CID 18508
2,2,8-Trimethyldecane
CID 522038
2,2,3-Trimethyldecane
CID 112483
3,3,4-Trimethyldecane
CID 39499
2,2,4-Trimethyldecane
CID 545792
2,2,3,3,5,6,6-Heptamethylheptane
CID 23652
2,2,6-Trimethyldecane
CID 545798
Pentamethylheptane
CID 3033849
2,2,3-Trimethylnonane
CID 41461
1-Methyl-1-(1-methylethyl)cyclohexane
CID 519284

Frequently Asked Questions

What is the IUPAC name of 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane?
The IUPAC name of 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane (CID 91220382) is 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane.
What is the SMILES notation for 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane?
The canonical SMILES for 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane is CC(C)CC1(C)CC(C)C1C.
What is the InChIKey of 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane?
The InChIKey is YNRSRBONVZQTAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-8(2)6-11(5)7-9(3)10(11)4/h8-10H,6-7H2,1-5H3.
What are the key properties of 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane?
1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane has a molecular weight of 154.30 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-trimethyl-1-(2-methylpropyl)cyclobutane is sourced from PubChem (CID 91220382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).