1-ethyl-1-methoxycyclopentane

C8H16O — CID 21039860

IUPAC1-ethyl-1-methoxycyclopentane
SMILESCCC1(OC)CCCC1
InChIInChI=1S/C8H16O/c1-3-8(9-2)6-4-5-7-8/h3-7H2,1-2H3
InChIKeySUTBBADFKCKKBQ-UHFFFAOYSA-N
MW128.22 g/mol
LogP2.36
Rot. Bonds2

About 1-ethyl-1-methoxycyclopentane

1-ethyl-1-methoxycyclopentane (PubChem CID 21039860) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is 1-ethyl-1-methoxycyclopentane.

Molecular Properties

Compound Name1-ethyl-1-methoxycyclopentane
PubChem CID21039860
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name1-ethyl-1-methoxycyclopentane
SMILESCCC1(OC)CCCC1
InChIInChI=1S/C8H16O/c1-3-8(9-2)6-4-5-7-8/h3-7H2,1-2H3
InChIKeySUTBBADFKCKKBQ-UHFFFAOYSA-N
XLogP2.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-methoxycyclopentane?
The IUPAC name of 1-ethyl-1-methoxycyclopentane (CID 21039860) is 1-ethyl-1-methoxycyclopentane.
What is the SMILES notation for 1-ethyl-1-methoxycyclopentane?
The canonical SMILES for 1-ethyl-1-methoxycyclopentane is CCC1(OC)CCCC1.
What is the InChIKey of 1-ethyl-1-methoxycyclopentane?
The InChIKey is SUTBBADFKCKKBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-3-8(9-2)6-4-5-7-8/h3-7H2,1-2H3.
What are the key properties of 1-ethyl-1-methoxycyclopentane?
1-ethyl-1-methoxycyclopentane has a molecular weight of 128.22 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-methoxycyclopentane is sourced from PubChem (CID 21039860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).