1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol

C12H24N2O — CID 54143780

IUPAC1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol
SMILESOC(CCC1CCCN1)C1CCNCC1
InChIInChI=1S/C12H24N2O/c15-12(10-5-8-13-9-6-10)4-3-11-2-1-7-14-11/h10-15H,1-9H2
InChIKeyWIGHGFSEPNSNQH-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.88
Rot. Bonds4

About 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol

1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol (PubChem CID 54143780) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol.

Molecular Properties

Compound Name1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol
PubChem CID54143780
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol
SMILESOC(CCC1CCCN1)C1CCNCC1
InChIInChI=1S/C12H24N2O/c15-12(10-5-8-13-9-6-10)4-3-11-2-1-7-14-11/h10-15H,1-9H2
InChIKeyWIGHGFSEPNSNQH-UHFFFAOYSA-N
XLogP0.88
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol?
The IUPAC name of 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol (CID 54143780) is 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol.
What is the SMILES notation for 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol?
The canonical SMILES for 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol is OC(CCC1CCCN1)C1CCNCC1.
What is the InChIKey of 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol?
The InChIKey is WIGHGFSEPNSNQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c15-12(10-5-8-13-9-6-10)4-3-11-2-1-7-14-11/h10-15H,1-9H2.
What are the key properties of 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol?
1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol has a molecular weight of 212.34 g/mol, XLogP of 0.88, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-yl-3-pyrrolidin-2-ylpropan-1-ol is sourced from PubChem (CID 54143780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).