2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol

C11H21NO2 — CID 103539245

IUPAC2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol
SMILESCOC1CCN(CC2CCCC2O)C1
InChIInChI=1S/C11H21NO2/c1-14-10-5-6-12(8-10)7-9-3-2-4-11(9)13/h9-11,13H,2-8H2,1H3
InChIKeyICOJJXGRLJKUHB-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.87
Rot. Bonds3

About 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol

2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol (PubChem CID 103539245) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol
PubChem CID103539245
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol
SMILESCOC1CCN(CC2CCCC2O)C1
InChIInChI=1S/C11H21NO2/c1-14-10-5-6-12(8-10)7-9-3-2-4-11(9)13/h9-11,13H,2-8H2,1H3
InChIKeyICOJJXGRLJKUHB-UHFFFAOYSA-N
XLogP0.87
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol (CID 103539245) is 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol is COC1CCN(CC2CCCC2O)C1.
What is the InChIKey of 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol?
The InChIKey is ICOJJXGRLJKUHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-14-10-5-6-12(8-10)7-9-3-2-4-11(9)13/h9-11,13H,2-8H2,1H3.
What are the key properties of 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol?
2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol has a molecular weight of 199.29 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxypyrrolidin-1-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 103539245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).