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

C12H23NO2 — CID 114800248

IUPAC2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol
SMILESOCCC1CCN(CC2CCCC2O)C1
InChIInChI=1S/C12H23NO2/c14-7-5-10-4-6-13(8-10)9-11-2-1-3-12(11)15/h10-12,14-15H,1-9H2
InChIKeyGXJGXWJDDLXPBC-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.85
Rot. Bonds4

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

2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol (PubChem CID 114800248) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol
PubChem CID114800248
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol
SMILESOCCC1CCN(CC2CCCC2O)C1
InChIInChI=1S/C12H23NO2/c14-7-5-10-4-6-13(8-10)9-11-2-1-3-12(11)15/h10-12,14-15H,1-9H2
InChIKeyGXJGXWJDDLXPBC-UHFFFAOYSA-N
XLogP0.85
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol (CID 114800248) is 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol is OCCC1CCN(CC2CCCC2O)C1.
What is the InChIKey of 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol?
The InChIKey is GXJGXWJDDLXPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c14-7-5-10-4-6-13(8-10)9-11-2-1-3-12(11)15/h10-12,14-15H,1-9H2.
What are the key properties of 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol?
2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol has a molecular weight of 213.32 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol is sourced from PubChem (CID 114800248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).