3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol

C12H24O3 — CID 103413817

IUPAC3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol
SMILESCOCCOCCCC1CCC(O)C1C
InChIInChI=1S/C12H24O3/c1-10-11(5-6-12(10)13)4-3-7-15-9-8-14-2/h10-13H,3-9H2,1-2H3
InChIKeyDTFLSNYUCCFIOR-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.84
Rot. Bonds7

About 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol

3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol (PubChem CID 103413817) has the molecular formula C12H24O3 and a molecular weight of 216.32 g/mol. Its IUPAC name is 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol.

Molecular Properties

Compound Name3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol
PubChem CID103413817
Molecular FormulaC12H24O3
Molecular Weight216.32 g/mol
Exact Mass216.17
IUPAC Name3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol
SMILESCOCCOCCCC1CCC(O)C1C
InChIInChI=1S/C12H24O3/c1-10-11(5-6-12(10)13)4-3-7-15-9-8-14-2/h10-13H,3-9H2,1-2H3
InChIKeyDTFLSNYUCCFIOR-UHFFFAOYSA-N
XLogP1.84
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[3-(2-methoxyethoxy)propyl]cyclobutan-1-amine
CID 103415817
2-[3-(2-methoxyethoxy)propyl]cyclopentane-1-carboxylic acid
CID 103415800
4-butyl-2,3-dimethylcyclohexan-1-ol
CID 58534220
2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]cyclopentan-1-ol
CID 104564618
2-[3-(2-methoxyethoxy)propyl]cyclohexan-1-amine
CID 103410699
N-[[2-[3-(2-methoxyethoxy)propyl]cyclobutyl]methyl]-2-methylpropan-2-amine
CID 103415897
4-ethyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexan-1-ol
CID 104565820
2-methyl-3-(propoxymethyl)cyclopentan-1-ol
CID 79568785
4-[3-(2-methoxyethoxy)propyl]thiolan-3-amine
CID 103410771
1-(2-methoxyethoxy)-4-[4-(2-methoxyethoxy)butoxy]butane
CID 58114561
1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine
CID 103415921
[2-(3-methoxypropyl)cyclobutyl]methanamine
CID 81010610

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol?
The IUPAC name of 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol (CID 103413817) is 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol.
What is the SMILES notation for 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol?
The canonical SMILES for 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol is COCCOCCCC1CCC(O)C1C.
What is the InChIKey of 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol?
The InChIKey is DTFLSNYUCCFIOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O3/c1-10-11(5-6-12(10)13)4-3-7-15-9-8-14-2/h10-13H,3-9H2,1-2H3.
What are the key properties of 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol?
3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol has a molecular weight of 216.32 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-methoxyethoxy)propyl]-2-methylcyclopentan-1-ol is sourced from PubChem (CID 103413817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).