1,2-dimethyl-3-pentan-2-ylcyclobutane

C11H22 — CID 123945019

IUPAC1,2-dimethyl-3-pentan-2-ylcyclobutane
SMILESCCCC(C)C1CC(C)C1C
InChIInChI=1S/C11H22/c1-5-6-8(2)11-7-9(3)10(11)4/h8-11H,5-7H2,1-4H3
InChIKeyAOGWOKUYDNQXJX-UHFFFAOYSA-N
MW154.30 g/mol
LogP3.71
Rot. Bonds3

About 1,2-dimethyl-3-pentan-2-ylcyclobutane

1,2-dimethyl-3-pentan-2-ylcyclobutane (PubChem CID 123945019) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 1,2-dimethyl-3-pentan-2-ylcyclobutane.

Molecular Properties

Compound Name1,2-dimethyl-3-pentan-2-ylcyclobutane
PubChem CID123945019
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name1,2-dimethyl-3-pentan-2-ylcyclobutane
SMILESCCCC(C)C1CC(C)C1C
InChIInChI=1S/C11H22/c1-5-6-8(2)11-7-9(3)10(11)4/h8-11H,5-7H2,1-4H3
InChIKeyAOGWOKUYDNQXJX-UHFFFAOYSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
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

Analyze 1,2-dimethyl-3-pentan-2-ylcyclobutane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,2-dimethyl-3-(4-methylhexan-2-yl)cyclobutane
CID 123367002
1-(2,3-dimethylcyclobutyl)butan-1-ol
CID 130831475
1,2-di(pentan-2-yl)cyclopropane
CID 123763474
1-heptan-2-yl-2-methylcyclopropane
CID 91084036
1,2-dimethyl-4-pentan-2-ylcyclopentane
CID 123931283
cis-(1R,2R)-1-methyl-2-pentan-2-ylcyclopentane
CID 54158802
1-ethyl-3-methyl-4-pentan-2-yl-2-propan-2-ylcyclopentane
CID 91297602
bis(3-methylhexane);1,2,3-trimethylcyclobutane
CID 162022066
N,2-dimethyl-3-pentan-2-ylcyclopentan-1-amine
CID 107888213
1-(1-chloropropyl)-2,3-dimethylcyclobutane
CID 131133771
1-(4-ethyl-5-methyloctan-2-yl)-2-methylcyclopropane
CID 123850669
1-methyl-2-(5-methylhexan-2-yl)cyclopropane
CID 91344454

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-3-pentan-2-ylcyclobutane?
The IUPAC name of 1,2-dimethyl-3-pentan-2-ylcyclobutane (CID 123945019) is 1,2-dimethyl-3-pentan-2-ylcyclobutane.
What is the SMILES notation for 1,2-dimethyl-3-pentan-2-ylcyclobutane?
The canonical SMILES for 1,2-dimethyl-3-pentan-2-ylcyclobutane is CCCC(C)C1CC(C)C1C.
What is the InChIKey of 1,2-dimethyl-3-pentan-2-ylcyclobutane?
The InChIKey is AOGWOKUYDNQXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-5-6-8(2)11-7-9(3)10(11)4/h8-11H,5-7H2,1-4H3.
What are the key properties of 1,2-dimethyl-3-pentan-2-ylcyclobutane?
1,2-dimethyl-3-pentan-2-ylcyclobutane has a molecular weight of 154.30 g/mol, XLogP of 3.71, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-3-pentan-2-ylcyclobutane is sourced from PubChem (CID 123945019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).