2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane

C12H24 — CID 91014133

IUPAC2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane
SMILESCCC(C)C(C)CC1CC1(C)C
InChIInChI=1S/C12H24/c1-6-9(2)10(3)7-11-8-12(11,4)5/h9-11H,6-8H2,1-5H3
InChIKeyCCDWFAYOVWQDSJ-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.10
Rot. Bonds4

About 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane

2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane (PubChem CID 91014133) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane.

Molecular Properties

Compound Name2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane
PubChem CID91014133
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane
SMILESCCC(C)C(C)CC1CC1(C)C
InChIInChI=1S/C12H24/c1-6-9(2)10(3)7-11-8-12(11,4)5/h9-11H,6-8H2,1-5H3
InChIKeyCCDWFAYOVWQDSJ-UHFFFAOYSA-N
XLogP4.10
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 ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane 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

2-(4,5-dimethylheptan-3-yl)-1,1-dimethylcyclopropane
CID 90861114
(3R,4R)-3,4-dimethylhexane;methane
CID 159261482
CID 91437014
CID 91437014
1-methyl-3-(3-methylpentan-2-yl)cyclobutan-1-amine
CID 123215051
1-(2,3-dimethylpentyl)-2-propylcyclopropane
CID 123708600
(2S,3S)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]-3-methylpentanoic acid
CID 106703216
2-(2,3-dimethylpentyl)-3-ethyloxirane
CID 131972305
2-ethyl-1-methyl-1-pent-3-en-2-ylcyclopropane
CID 123462514
(4S)-3,4-dimethylhexane;methyliodanuidylmethane
CID 168990410
1,1-dimethyl-2-prop-2-enylcyclopropane
CID 534921
2-(chloromethyl)-1,1-dimethylcyclopropane
CID 12627051
1-butan-2-yl-2-ethylcyclopropan-1-amine
CID 79332461

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane?
The IUPAC name of 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane (CID 91014133) is 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane.
What is the SMILES notation for 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane?
The canonical SMILES for 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane is CCC(C)C(C)CC1CC1(C)C.
What is the InChIKey of 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane?
The InChIKey is CCDWFAYOVWQDSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-6-9(2)10(3)7-11-8-12(11,4)5/h9-11H,6-8H2,1-5H3.
What are the key properties of 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane?
2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane has a molecular weight of 168.32 g/mol, XLogP of 4.10, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylpentyl)-1,1-dimethylcyclopropane is sourced from PubChem (CID 91014133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).