1-ethyl-1-(2-methylpentan-3-yl)cyclobutane

C12H24 — CID 170720683

IUPAC1-ethyl-1-(2-methylpentan-3-yl)cyclobutane
SMILESCCC(C(C)C)C1(CC)CCC1
InChIInChI=1S/C12H24/c1-5-11(10(3)4)12(6-2)8-7-9-12/h10-11H,5-9H2,1-4H3
InChIKeyQQDKDIWYUGBDPC-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.25
Rot. Bonds4

About 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane

1-ethyl-1-(2-methylpentan-3-yl)cyclobutane (PubChem CID 170720683) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane.

Molecular Properties

Compound Name1-ethyl-1-(2-methylpentan-3-yl)cyclobutane
PubChem CID170720683
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name1-ethyl-1-(2-methylpentan-3-yl)cyclobutane
SMILESCCC(C(C)C)C1(CC)CCC1
InChIInChI=1S/C12H24/c1-5-11(10(3)4)12(6-2)8-7-9-12/h10-11H,5-9H2,1-4H3
InChIKeyQQDKDIWYUGBDPC-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane 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-ethyl-3-methyl-1-(2-methylpentan-3-yl)cyclopentane
CID 123692512
[1-(1-ethylcyclopentyl)-2-methylpropyl]hydrazine
CID 105281723
1-ethyl-1-propan-2-ylcyclopropane
CID 22977902
1-(1-ethylcyclohexyl)-N-methylethanamine
CID 142438459
2-ethyl-1-(1-ethylcyclopentyl)butan-1-amine
CID 105013946
1-but-3-en-2-yl-1-ethylcyclopentane;propane
CID 145053026
1-(methoxymethyl)-1-propan-2-ylcyclobutane
CID 90167872
1-(1-ethylcyclopropyl)-2,2-dimethylpropan-1-amine
CID 130554169
N-[3-(1-ethylcyclopropyl)-2-methylbutan-2-yl]methanimine
CID 123300900
1-(2,3-dimethylpentan-2-yl)-1-methylcyclobutane
CID 123373940
1-tert-butyl-1-(2,2-dimethylpentan-3-yl)cyclobutane
CID 165174323
1-(1-ethylcyclopentyl)-2-propan-2-yloxyethanol
CID 115821425

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane?
The IUPAC name of 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane (CID 170720683) is 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane.
What is the SMILES notation for 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane?
The canonical SMILES for 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane is CCC(C(C)C)C1(CC)CCC1.
What is the InChIKey of 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane?
The InChIKey is QQDKDIWYUGBDPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-5-11(10(3)4)12(6-2)8-7-9-12/h10-11H,5-9H2,1-4H3.
What are the key properties of 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane?
1-ethyl-1-(2-methylpentan-3-yl)cyclobutane has a molecular weight of 168.32 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(2-methylpentan-3-yl)cyclobutane is sourced from PubChem (CID 170720683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).