cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane

C10H20O2 — CID 153320614

IUPACcis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane
SMILESCC[C@@H]1CC(OC)C[C@@H]1COC
InChIInChI=1S/C10H20O2/c1-4-8-5-10(12-3)6-9(8)7-11-2/h8-10H,4-7H2,1-3H3/t8-,9-,10?/m1/s1
InChIKeyRXSVHSCWCKTDCZ-MGRQHWMJSA-N
MW172.27 g/mol
LogP2.08
Rot. Bonds4

About cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane

cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane (PubChem CID 153320614) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane.

Molecular Properties

Compound Namecis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane
PubChem CID153320614
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Namecis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane
SMILESCC[C@@H]1CC(OC)C[C@@H]1COC
InChIInChI=1S/C10H20O2/c1-4-8-5-10(12-3)6-9(8)7-11-2/h8-10H,4-7H2,1-3H3/t8-,9-,10?/m1/s1
InChIKeyRXSVHSCWCKTDCZ-MGRQHWMJSA-N
XLogP2.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.08
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-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane?
The IUPAC name of cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane (CID 153320614) is cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane.
What is the SMILES notation for cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane?
The canonical SMILES for cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane is CC[C@@H]1CC(OC)C[C@@H]1COC.
What is the InChIKey of cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane?
The InChIKey is RXSVHSCWCKTDCZ-MGRQHWMJSA-N. The full InChI is InChI=1S/C10H20O2/c1-4-8-5-10(12-3)6-9(8)7-11-2/h8-10H,4-7H2,1-3H3/t8-,9-,10?/m1/s1.
What are the key properties of cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane?
cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane has a molecular weight of 172.27 g/mol, XLogP of 2.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-1-ethyl-4-methoxy-2-(methoxymethyl)cyclopentane is sourced from PubChem (CID 153320614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).