1-methoxy-3-(methoxymethyl)-2-methylcyclopentane

C9H18O2 — CID 153320618

IUPAC1-methoxy-3-(methoxymethyl)-2-methylcyclopentane
SMILESCOCC1CCC(OC)C1C
InChIInChI=1S/C9H18O2/c1-7-8(6-10-2)4-5-9(7)11-3/h7-9H,4-6H2,1-3H3
InChIKeyYOTOWRHNRWEECT-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.69
Rot. Bonds3

About 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane

1-methoxy-3-(methoxymethyl)-2-methylcyclopentane (PubChem CID 153320618) has the molecular formula C9H18O2 and a molecular weight of 158.24 g/mol. Its IUPAC name is 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane.

Molecular Properties

Compound Name1-methoxy-3-(methoxymethyl)-2-methylcyclopentane
PubChem CID153320618
Molecular FormulaC9H18O2
Molecular Weight158.24 g/mol
Exact Mass158.13
IUPAC Name1-methoxy-3-(methoxymethyl)-2-methylcyclopentane
SMILESCOCC1CCC(OC)C1C
InChIInChI=1S/C9H18O2/c1-7-8(6-10-2)4-5-9(7)11-3/h7-9H,4-6H2,1-3H3
InChIKeyYOTOWRHNRWEECT-UHFFFAOYSA-N
XLogP1.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane?
The IUPAC name of 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane (CID 153320618) is 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane.
What is the SMILES notation for 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane?
The canonical SMILES for 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane is COCC1CCC(OC)C1C.
What is the InChIKey of 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane?
The InChIKey is YOTOWRHNRWEECT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2/c1-7-8(6-10-2)4-5-9(7)11-3/h7-9H,4-6H2,1-3H3.
What are the key properties of 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane?
1-methoxy-3-(methoxymethyl)-2-methylcyclopentane has a molecular weight of 158.24 g/mol, XLogP of 1.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-(methoxymethyl)-2-methylcyclopentane is sourced from PubChem (CID 153320618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).