cis-(1R,2S)-1,2-dimethoxycyclopentane

C7H14O2 — CID 21122335

IUPACcis-(1R,2S)-1,2-dimethoxycyclopentane
SMILESCO[C@H]1CCC[C@H]1OC
InChIInChI=1S/C7H14O2/c1-8-6-4-3-5-7(6)9-2/h6-7H,3-5H2,1-2H3/t6-,7+
InChIKeyYLBQPTZQSYROOF-KNVOCYPGSA-N
MW130.19 g/mol
LogP1.20
Rot. Bonds2

About cis-(1R,2S)-1,2-dimethoxycyclopentane

cis-(1R,2S)-1,2-dimethoxycyclopentane (PubChem CID 21122335) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is cis-(1R,2S)-1,2-dimethoxycyclopentane.

Molecular Properties

Compound Namecis-(1R,2S)-1,2-dimethoxycyclopentane
PubChem CID21122335
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Namecis-(1R,2S)-1,2-dimethoxycyclopentane
SMILESCO[C@H]1CCC[C@H]1OC
InChIInChI=1S/C7H14O2/c1-8-6-4-3-5-7(6)9-2/h6-7H,3-5H2,1-2H3/t6-,7+
InChIKeyYLBQPTZQSYROOF-KNVOCYPGSA-N
XLogP1.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-1,2-dimethoxycyclopentane?
The IUPAC name of cis-(1R,2S)-1,2-dimethoxycyclopentane (CID 21122335) is cis-(1R,2S)-1,2-dimethoxycyclopentane.
What is the SMILES notation for cis-(1R,2S)-1,2-dimethoxycyclopentane?
The canonical SMILES for cis-(1R,2S)-1,2-dimethoxycyclopentane is CO[C@H]1CCC[C@H]1OC.
What is the InChIKey of cis-(1R,2S)-1,2-dimethoxycyclopentane?
The InChIKey is YLBQPTZQSYROOF-KNVOCYPGSA-N. The full InChI is InChI=1S/C7H14O2/c1-8-6-4-3-5-7(6)9-2/h6-7H,3-5H2,1-2H3/t6-,7+.
What are the key properties of cis-(1R,2S)-1,2-dimethoxycyclopentane?
cis-(1R,2S)-1,2-dimethoxycyclopentane has a molecular weight of 130.19 g/mol, XLogP of 1.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-1,2-dimethoxycyclopentane is sourced from PubChem (CID 21122335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).