2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol

C11H21NO — CID 115665613

IUPAC2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol
SMILESOCCC1CCN(CCC2CC2)C1
InChIInChI=1S/C11H21NO/c13-8-5-11-4-7-12(9-11)6-3-10-1-2-10/h10-11,13H,1-9H2
InChIKeyKRTFPIHXTJUUBV-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.49
Rot. Bonds5

About 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol

2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol (PubChem CID 115665613) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol.

Molecular Properties

Compound Name2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol
PubChem CID115665613
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol
SMILESOCCC1CCN(CCC2CC2)C1
InChIInChI=1S/C11H21NO/c13-8-5-11-4-7-12(9-11)6-3-10-1-2-10/h10-11,13H,1-9H2
InChIKeyKRTFPIHXTJUUBV-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol?
The IUPAC name of 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol (CID 115665613) is 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol.
What is the SMILES notation for 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol?
The canonical SMILES for 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol is OCCC1CCN(CCC2CC2)C1.
What is the InChIKey of 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol?
The InChIKey is KRTFPIHXTJUUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c13-8-5-11-4-7-12(9-11)6-3-10-1-2-10/h10-11,13H,1-9H2.
What are the key properties of 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol?
2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol has a molecular weight of 183.29 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-cyclopropylethyl)pyrrolidin-3-yl]ethanol is sourced from PubChem (CID 115665613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).