(3-cyclopentyl-2,2-dimethylcyclopentyl) acetate

C14H24O2 — CID 11521441

IUPAC(3-cyclopentyl-2,2-dimethylcyclopentyl) acetate
SMILESCC(=O)OC1CCC(C2CCCC2)C1(C)C
InChIInChI=1S/C14H24O2/c1-10(15)16-13-9-8-12(14(13,2)3)11-6-4-5-7-11/h11-13H,4-9H2,1-3H3
InChIKeyPFFRVGYGEBBMHP-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.54
Rot. Bonds2

About (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate

(3-cyclopentyl-2,2-dimethylcyclopentyl) acetate (PubChem CID 11521441) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate.

Molecular Properties

Compound Name(3-cyclopentyl-2,2-dimethylcyclopentyl) acetate
PubChem CID11521441
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name(3-cyclopentyl-2,2-dimethylcyclopentyl) acetate
SMILESCC(=O)OC1CCC(C2CCCC2)C1(C)C
InChIInChI=1S/C14H24O2/c1-10(15)16-13-9-8-12(14(13,2)3)11-6-4-5-7-11/h11-13H,4-9H2,1-3H3
InChIKeyPFFRVGYGEBBMHP-UHFFFAOYSA-N
XLogP3.54
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate 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

(2,2-dimethyl-3,4,4a,5,6,7,8,8a-octahydrochromen-3-yl) acetate
CID 13492071
2,3,3a,4,5,6,7,7a-octahydro-1H-inden-2-yl acetate
CID 142155546
(2,2-dimethyloxan-3-yl) acetate
CID 155712609
bis(1,1-dimethyl-3,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydro-2H-phenanthren-2-yl) sulfate
CID 118905009
(6-acetyloxycyclodecyl) acetate
CID 539578
[(5S,8R,9R,10R,13R,14R,17R)-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] acetate
CID 125028130
[(5S,8R,9S,10R,13S,14S,17S)-10,13-dimethyl-4-oxo-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] acetate
CID 10426901
[(8R,9R,10R,13S,14S)-10,13-dimethyl-4-oxo-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl] acetate
CID 57285120
[(4S,5R,8R,9S,10R,13S,14S,17S)-4-formyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
CID 11198799
[(1R,2R,4R)-7,7-dimethyl-2-bicyclo[2.2.1]heptanyl] acetate
CID 13094010
cycloheptadecyl acetate
CID 57215828
[(5R,8R,9S,10S,12S,13R,14S)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-12-yl] acetate
CID 99571764

Frequently Asked Questions

What is the IUPAC name of (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate?
The IUPAC name of (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate (CID 11521441) is (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate.
What is the SMILES notation for (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate?
The canonical SMILES for (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate is CC(=O)OC1CCC(C2CCCC2)C1(C)C.
What is the InChIKey of (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate?
The InChIKey is PFFRVGYGEBBMHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-10(15)16-13-9-8-12(14(13,2)3)11-6-4-5-7-11/h11-13H,4-9H2,1-3H3.
What are the key properties of (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate?
(3-cyclopentyl-2,2-dimethylcyclopentyl) acetate has a molecular weight of 224.34 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopentyl-2,2-dimethylcyclopentyl) acetate is sourced from PubChem (CID 11521441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).