1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol

C11H22O2 — CID 130445471

IUPAC1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol
SMILESCC(C)(C)OCCC1(O)CCCC1
InChIInChI=1S/C11H22O2/c1-10(2,3)13-9-8-11(12)6-4-5-7-11/h12H,4-9H2,1-3H3
InChIKeyMGABZJJMIPETCS-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.50
Rot. Bonds3

About 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol

1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol (PubChem CID 130445471) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol
PubChem CID130445471
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol
SMILESCC(C)(C)OCCC1(O)CCCC1
InChIInChI=1S/C11H22O2/c1-10(2,3)13-9-8-11(12)6-4-5-7-11/h12H,4-9H2,1-3H3
InChIKeyMGABZJJMIPETCS-UHFFFAOYSA-N
XLogP2.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol?
The IUPAC name of 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol (CID 130445471) is 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol?
The canonical SMILES for 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol is CC(C)(C)OCCC1(O)CCCC1.
What is the InChIKey of 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol?
The InChIKey is MGABZJJMIPETCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-10(2,3)13-9-8-11(12)6-4-5-7-11/h12H,4-9H2,1-3H3.
What are the key properties of 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol?
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol has a molecular weight of 186.29 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopentan-1-ol is sourced from PubChem (CID 130445471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).