1,4-diethyl-2-methoxycyclopentane

C10H20O — CID 20743798

IUPAC1,4-diethyl-2-methoxycyclopentane
SMILESCCC1CC(CC)C(OC)C1
InChIInChI=1S/C10H20O/c1-4-8-6-9(5-2)10(7-8)11-3/h8-10H,4-7H2,1-3H3
InChIKeyAPNOSTDONJJOIV-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.85
Rot. Bonds3

About 1,4-diethyl-2-methoxycyclopentane

1,4-diethyl-2-methoxycyclopentane (PubChem CID 20743798) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 1,4-diethyl-2-methoxycyclopentane.

Molecular Properties

Compound Name1,4-diethyl-2-methoxycyclopentane
PubChem CID20743798
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name1,4-diethyl-2-methoxycyclopentane
SMILESCCC1CC(CC)C(OC)C1
InChIInChI=1S/C10H20O/c1-4-8-6-9(5-2)10(7-8)11-3/h8-10H,4-7H2,1-3H3
InChIKeyAPNOSTDONJJOIV-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,4-diethyl-2-methoxycyclopentane?
The IUPAC name of 1,4-diethyl-2-methoxycyclopentane (CID 20743798) is 1,4-diethyl-2-methoxycyclopentane.
What is the SMILES notation for 1,4-diethyl-2-methoxycyclopentane?
The canonical SMILES for 1,4-diethyl-2-methoxycyclopentane is CCC1CC(CC)C(OC)C1.
What is the InChIKey of 1,4-diethyl-2-methoxycyclopentane?
The InChIKey is APNOSTDONJJOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-4-8-6-9(5-2)10(7-8)11-3/h8-10H,4-7H2,1-3H3.
What are the key properties of 1,4-diethyl-2-methoxycyclopentane?
1,4-diethyl-2-methoxycyclopentane has a molecular weight of 156.27 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-diethyl-2-methoxycyclopentane is sourced from PubChem (CID 20743798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).