(2-ethyl-4-methylcyclopentyl) acetate

C10H18O2 — CID 153203207

IUPAC(2-ethyl-4-methylcyclopentyl) acetate
SMILESCCC1CC(C)CC1OC(C)=O
InChIInChI=1S/C10H18O2/c1-4-9-5-7(2)6-10(9)12-8(3)11/h7,9-10H,4-6H2,1-3H3
InChIKeyWKHXDLGLWATXFT-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.37
Rot. Bonds2

About (2-ethyl-4-methylcyclopentyl) acetate

(2-ethyl-4-methylcyclopentyl) acetate (PubChem CID 153203207) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is (2-ethyl-4-methylcyclopentyl) acetate.

Molecular Properties

Compound Name(2-ethyl-4-methylcyclopentyl) acetate
PubChem CID153203207
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name(2-ethyl-4-methylcyclopentyl) acetate
SMILESCCC1CC(C)CC1OC(C)=O
InChIInChI=1S/C10H18O2/c1-4-9-5-7(2)6-10(9)12-8(3)11/h7,9-10H,4-6H2,1-3H3
InChIKeyWKHXDLGLWATXFT-UHFFFAOYSA-N
XLogP2.37
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2-ethyl-4-methylcyclopentyl) 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

(3-ethyl-2-methylcyclohexyl) acetate
CID 146440367
[(1R,2S,4R,5S)-2,4,5-triacetyloxycyclohexyl] acetate
CID 12026265
ethyl 2-[(1R,2R,3R,5R)-3-acetyloxy-2-(3-acetyloxypropyl)-5-methylcyclohexyl]acetate
CID 102160537
[(1R,2R,3R,4R)-2,3,4-triacetyloxycyclopentyl] acetate
CID 101209546
[(1S,2R)-2-acetyloxy-4-hydroxycyclopentyl] acetate
CID 67582047
cis-(3S,5R)-3,5-diacetyloxy-4-methylcyclohexane-1-carboxylic acid
CID 101093192
[(2R,3R,4R)-2-ethyl-6-hydroxy-3-methyloxan-4-yl] acetate
CID 134194797
[(1R,2S,5R)-2-tert-butyl-5-methylcyclohexyl] acetate
CID 58788414
[(1R,2R,3S,4S)-2,3,4,5-tetraacetyloxycyclohexyl]methyl acetate
CID 153447573
methane;(5-methyl-2-propan-2-ylcyclohexyl) acetate
CID 157342153
[(1R,2S,5S)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexyl] acetate
CID 102202477
[(2R,3S,5R)-5-acetyloxy-2,3,4-trimethylcyclohexyl]methyl acetate
CID 129224577

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-4-methylcyclopentyl) acetate?
The IUPAC name of (2-ethyl-4-methylcyclopentyl) acetate (CID 153203207) is (2-ethyl-4-methylcyclopentyl) acetate.
What is the SMILES notation for (2-ethyl-4-methylcyclopentyl) acetate?
The canonical SMILES for (2-ethyl-4-methylcyclopentyl) acetate is CCC1CC(C)CC1OC(C)=O.
What is the InChIKey of (2-ethyl-4-methylcyclopentyl) acetate?
The InChIKey is WKHXDLGLWATXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-4-9-5-7(2)6-10(9)12-8(3)11/h7,9-10H,4-6H2,1-3H3.
What are the key properties of (2-ethyl-4-methylcyclopentyl) acetate?
(2-ethyl-4-methylcyclopentyl) acetate has a molecular weight of 170.25 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-4-methylcyclopentyl) acetate is sourced from PubChem (CID 153203207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).