1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol

C11H22N2O — CID 130787822

IUPAC1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol
SMILESCC(C1CCCN1)N1CCC(O)CC1
InChIInChI=1S/C11H22N2O/c1-9(11-3-2-6-12-11)13-7-4-10(14)5-8-13/h9-12,14H,2-8H2,1H3
InChIKeyDUDCZDXOLSIACI-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.58
Rot. Bonds2

About 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol

1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol (PubChem CID 130787822) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol
PubChem CID130787822
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol
SMILESCC(C1CCCN1)N1CCC(O)CC1
InChIInChI=1S/C11H22N2O/c1-9(11-3-2-6-12-11)13-7-4-10(14)5-8-13/h9-12,14H,2-8H2,1H3
InChIKeyDUDCZDXOLSIACI-UHFFFAOYSA-N
XLogP0.58
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol?
The IUPAC name of 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol (CID 130787822) is 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol.
What is the SMILES notation for 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol?
The canonical SMILES for 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol is CC(C1CCCN1)N1CCC(O)CC1.
What is the InChIKey of 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol?
The InChIKey is DUDCZDXOLSIACI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(11-3-2-6-12-11)13-7-4-10(14)5-8-13/h9-12,14H,2-8H2,1H3.
What are the key properties of 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol?
1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol has a molecular weight of 198.31 g/mol, XLogP of 0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-pyrrolidin-2-ylethyl)piperidin-4-ol is sourced from PubChem (CID 130787822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).