ethoxycyclopentane

C7H14O — CID 13427979

IUPACethoxycyclopentane
SMILESCCOC1CCCC1
InChIInChI=1S/C7H14O/c1-2-8-7-5-3-4-6-7/h7H,2-6H2,1H3
InChIKeyAOWTYVFGMCEIRN-UHFFFAOYSA-N
MW114.19 g/mol
LogP1.97
Rot. Bonds2

About ethoxycyclopentane

ethoxycyclopentane (PubChem CID 13427979) has the molecular formula C7H14O and a molecular weight of 114.19 g/mol. Its IUPAC name is ethoxycyclopentane.

Molecular Properties

Compound Nameethoxycyclopentane
PubChem CID13427979
Molecular FormulaC7H14O
Molecular Weight114.19 g/mol
Exact Mass114.10
IUPAC Nameethoxycyclopentane
SMILESCCOC1CCCC1
InChIInChI=1S/C7H14O/c1-2-8-7-5-3-4-6-7/h7H,2-6H2,1H3
InChIKeyAOWTYVFGMCEIRN-UHFFFAOYSA-N
XLogP1.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-Methyltetrahydrofuran
CID 7301
2,5-Dimethyltetrahydrofuran
CID 13855
Cyclopentyl methyl ether
CID 138539
2,5-Dimethyloxolane, cis-
CID 16508
2-Methyltetrahydrofuran, (R)-
CID 641521
trans-2,5-Dimethyloxolane
CID 7567603
2-Methyltetrahydrofuran, (S)-
CID 7568485
(2S,5S)-2,5-dimethyloxolane
CID 7567598
5-methyl-3,4-dihydro-2H-furan-5-ylium
CID 12939308
trans-(1S,2S)-1-ethoxy-2-iodocyclopentane
CID 11118152
CID 101002336
CID 101002336
(2S)-2,5-dimethyloxolane
CID 118613003

Frequently Asked Questions

What is the IUPAC name of ethoxycyclopentane?
The IUPAC name of ethoxycyclopentane (CID 13427979) is ethoxycyclopentane.
What is the SMILES notation for ethoxycyclopentane?
The canonical SMILES for ethoxycyclopentane is CCOC1CCCC1.
What is the InChIKey of ethoxycyclopentane?
The InChIKey is AOWTYVFGMCEIRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O/c1-2-8-7-5-3-4-6-7/h7H,2-6H2,1H3.
What are the key properties of ethoxycyclopentane?
ethoxycyclopentane has a molecular weight of 114.19 g/mol, XLogP of 1.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxycyclopentane is sourced from PubChem (CID 13427979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).