ethane;2-methoxycyclopentan-1-ol

C8H18O2 — CID 177178786

IUPACethane;2-methoxycyclopentan-1-ol
SMILESCC.COC1CCCC1O
InChIInChI=1S/C6H12O2.C2H6/c1-8-6-4-2-3-5(6)7;1-2/h5-7H,2-4H2,1H3;1-2H3
InChIKeyQVLXVGCTGWYRJE-UHFFFAOYSA-N
MW146.23 g/mol
LogP1.57
Rot. Bonds1

About ethane;2-methoxycyclopentan-1-ol

ethane;2-methoxycyclopentan-1-ol (PubChem CID 177178786) has the molecular formula C8H18O2 and a molecular weight of 146.23 g/mol. Its IUPAC name is ethane;2-methoxycyclopentan-1-ol.

Molecular Properties

Compound Nameethane;2-methoxycyclopentan-1-ol
PubChem CID177178786
Molecular FormulaC8H18O2
Molecular Weight146.23 g/mol
Exact Mass146.13
IUPAC Nameethane;2-methoxycyclopentan-1-ol
SMILESCC.COC1CCCC1O
InChIInChI=1S/C6H12O2.C2H6/c1-8-6-4-2-3-5(6)7;1-2/h5-7H,2-4H2,1H3;1-2H3
InChIKeyQVLXVGCTGWYRJE-UHFFFAOYSA-N
XLogP1.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;2-methoxycyclopentan-1-ol?
The IUPAC name of ethane;2-methoxycyclopentan-1-ol (CID 177178786) is ethane;2-methoxycyclopentan-1-ol.
What is the SMILES notation for ethane;2-methoxycyclopentan-1-ol?
The canonical SMILES for ethane;2-methoxycyclopentan-1-ol is CC.COC1CCCC1O.
What is the InChIKey of ethane;2-methoxycyclopentan-1-ol?
The InChIKey is QVLXVGCTGWYRJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O2.C2H6/c1-8-6-4-2-3-5(6)7;1-2/h5-7H,2-4H2,1H3;1-2H3.
What are the key properties of ethane;2-methoxycyclopentan-1-ol?
ethane;2-methoxycyclopentan-1-ol has a molecular weight of 146.23 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methoxycyclopentan-1-ol is sourced from PubChem (CID 177178786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).