1-(2,2-dimethylpropyl)-3-methylcyclopentane

C11H22 — CID 58530421

IUPAC1-(2,2-dimethylpropyl)-3-methylcyclopentane
SMILESCC1CCC(CC(C)(C)C)C1
InChIInChI=1S/C11H22/c1-9-5-6-10(7-9)8-11(2,3)4/h9-10H,5-8H2,1-4H3
InChIKeyJRZAVOBSKNFOLF-UHFFFAOYSA-N
MW154.30 g/mol
LogP3.86
Rot. Bonds1

About 1-(2,2-dimethylpropyl)-3-methylcyclopentane

1-(2,2-dimethylpropyl)-3-methylcyclopentane (PubChem CID 58530421) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)-3-methylcyclopentane.

Molecular Properties

Compound Name1-(2,2-dimethylpropyl)-3-methylcyclopentane
PubChem CID58530421
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name1-(2,2-dimethylpropyl)-3-methylcyclopentane
SMILESCC1CCC(CC(C)(C)C)C1
InChIInChI=1S/C11H22/c1-9-5-6-10(7-9)8-11(2,3)4/h9-10H,5-8H2,1-4H3
InChIKeyJRZAVOBSKNFOLF-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-(2,2-dimethylpropyl)-3-methylcyclopentane 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

cis-(1S,3R)-1-(2,2-dimethylpropyl)-3-methylcyclohexane
CID 158565558
trans-(1R,3R)-1-ethyl-3-methylcyclopentane
CID 6432281
[(1R,3R)-3-(2,2-dimethylpropyl)cyclopentyl]methanol
CID 59479700
1-ethyl-3-methylcyclopentane;methane
CID 144878558
cis-(1R,3S)-1-methyl-3-propylcyclopentane
CID 59954450
2-(2,2-dimethylpropyl)-4-methylcyclohexan-1-ol
CID 58331735
1,3,6-trimethyl-9-propylcycloundecane
CID 123524783
ethane;1-ethyl-3-methylcyclopentane;propane
CID 162724800
ethane;1-ethyl-3-methylcyclopentane;methane
CID 143549487
5,5-dimethyl-1-(3-methylcyclopentyl)hexan-2-one
CID 167537268
1-(1,1-dideuterio-2,2-dimethylpropyl)-4-methylcyclohexane
CID 165161493
(3R)-1,3-dimethylcyclopentane
CID 13119651

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropyl)-3-methylcyclopentane?
The IUPAC name of 1-(2,2-dimethylpropyl)-3-methylcyclopentane (CID 58530421) is 1-(2,2-dimethylpropyl)-3-methylcyclopentane.
What is the SMILES notation for 1-(2,2-dimethylpropyl)-3-methylcyclopentane?
The canonical SMILES for 1-(2,2-dimethylpropyl)-3-methylcyclopentane is CC1CCC(CC(C)(C)C)C1.
What is the InChIKey of 1-(2,2-dimethylpropyl)-3-methylcyclopentane?
The InChIKey is JRZAVOBSKNFOLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-9-5-6-10(7-9)8-11(2,3)4/h9-10H,5-8H2,1-4H3.
What are the key properties of 1-(2,2-dimethylpropyl)-3-methylcyclopentane?
1-(2,2-dimethylpropyl)-3-methylcyclopentane has a molecular weight of 154.30 g/mol, XLogP of 3.86, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropyl)-3-methylcyclopentane is sourced from PubChem (CID 58530421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).