[1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane

C15H30O2 — CID 90169995

IUPAC[1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane
SMILESCCCC(C)C(COC)(COC)C1CCCC1
InChIInChI=1S/C15H30O2/c1-5-8-13(2)15(11-16-3,12-17-4)14-9-6-7-10-14/h13-14H,5-12H2,1-4H3
InChIKeyCKNLOSXTZHSNRY-UHFFFAOYSA-N
MW242.40 g/mol
LogP3.89
Rot. Bonds8

About [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane

[1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane (PubChem CID 90169995) has the molecular formula C15H30O2 and a molecular weight of 242.40 g/mol. Its IUPAC name is [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane.

Molecular Properties

Compound Name[1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane
PubChem CID90169995
Molecular FormulaC15H30O2
Molecular Weight242.40 g/mol
Exact Mass242.22
IUPAC Name[1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane
SMILESCCCC(C)C(COC)(COC)C1CCCC1
InChIInChI=1S/C15H30O2/c1-5-8-13(2)15(11-16-3,12-17-4)14-9-6-7-10-14/h13-14H,5-12H2,1-4H3
InChIKeyCKNLOSXTZHSNRY-UHFFFAOYSA-N
XLogP3.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.40
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-2-(methoxymethyl)-3-methylbutan-1-amine
CID 139927528
2-cyclopentyl-N-ethyl-2-(methoxymethyl)-3-methylbutan-1-amine
CID 139968893
(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane
CID 89106500
(2-cyclohexyl-1,3-dimethoxybutan-2-yl)cyclohexane
CID 66896613
3-(methoxymethyl)-4-methylheptan-3-ol
CID 107892647
2,3-dimethyloctan-2-ylcyclohexane;ethane
CID 143333378
(1,1-dicyclohexyl-2-methylhexyl)cyclohexane
CID 141441140
dimethyl 2-cyclopentyl-2-(2-methylpentyl)propanedioate
CID 103973134
(1,1-diethoxy-2-methyldecyl)cyclohexane
CID 151955749
2-cyclohexyl-5-methoxy-3-methylpentan-2-ol
CID 114795055
2-cyclohexyl-2-(methoxymethyl)pentan-1-amine
CID 139927573
2-cyclopentyl-2-(methoxymethyl)-4-methylpentan-1-amine
CID 139968950

Frequently Asked Questions

What is the IUPAC name of [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane?
The IUPAC name of [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane (CID 90169995) is [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane.
What is the SMILES notation for [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane?
The canonical SMILES for [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane is CCCC(C)C(COC)(COC)C1CCCC1.
What is the InChIKey of [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane?
The InChIKey is CKNLOSXTZHSNRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O2/c1-5-8-13(2)15(11-16-3,12-17-4)14-9-6-7-10-14/h13-14H,5-12H2,1-4H3.
What are the key properties of [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane?
[1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane has a molecular weight of 242.40 g/mol, XLogP of 3.89, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-methoxy-2-(methoxymethyl)-3-methylhexan-2-yl]cyclopentane is sourced from PubChem (CID 90169995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).