3-ethyl-5-pyrrolidin-1-ylpentan-1-ol

C11H23NO — CID 67829596

IUPAC3-ethyl-5-pyrrolidin-1-ylpentan-1-ol
SMILESCCC(CCO)CCN1CCCC1
InChIInChI=1S/C11H23NO/c1-2-11(6-10-13)5-9-12-7-3-4-8-12/h11,13H,2-10H2,1H3
InChIKeyPBJSVJDJLMVZJR-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.88
Rot. Bonds6

About 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol

3-ethyl-5-pyrrolidin-1-ylpentan-1-ol (PubChem CID 67829596) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol.

Molecular Properties

Compound Name3-ethyl-5-pyrrolidin-1-ylpentan-1-ol
PubChem CID67829596
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name3-ethyl-5-pyrrolidin-1-ylpentan-1-ol
SMILESCCC(CCO)CCN1CCCC1
InChIInChI=1S/C11H23NO/c1-2-11(6-10-13)5-9-12-7-3-4-8-12/h11,13H,2-10H2,1H3
InChIKeyPBJSVJDJLMVZJR-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol?
The IUPAC name of 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol (CID 67829596) is 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol.
What is the SMILES notation for 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol?
The canonical SMILES for 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol is CCC(CCO)CCN1CCCC1.
What is the InChIKey of 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol?
The InChIKey is PBJSVJDJLMVZJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-2-11(6-10-13)5-9-12-7-3-4-8-12/h11,13H,2-10H2,1H3.
What are the key properties of 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol?
3-ethyl-5-pyrrolidin-1-ylpentan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-pyrrolidin-1-ylpentan-1-ol is sourced from PubChem (CID 67829596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).