1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine

C15H24N4 — CID 114704870

IUPAC1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
SMILESc1ncn(C2CCN3CCCC23)c1C1CCCCN1
InChIInChI=1S/C15H24N4/c1-2-7-17-12(4-1)15-10-16-11-19(15)14-6-9-18-8-3-5-13(14)18/h10-14,17H,1-9H2
InChIKeyRXDQYHBSYLFZBD-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.11
Rot. Bonds2

About 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine

1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine (PubChem CID 114704870) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine.

Molecular Properties

Compound Name1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
PubChem CID114704870
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
SMILESc1ncn(C2CCN3CCCC23)c1C1CCCCN1
InChIInChI=1S/C15H24N4/c1-2-7-17-12(4-1)15-10-16-11-19(15)14-6-9-18-8-3-5-13(14)18/h10-14,17H,1-9H2
InChIKeyRXDQYHBSYLFZBD-UHFFFAOYSA-N
XLogP2.11
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine?
The IUPAC name of 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine (CID 114704870) is 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine.
What is the SMILES notation for 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine?
The canonical SMILES for 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine is c1ncn(C2CCN3CCCC23)c1C1CCCCN1.
What is the InChIKey of 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine?
The InChIKey is RXDQYHBSYLFZBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-2-7-17-12(4-1)15-10-16-11-19(15)14-6-9-18-8-3-5-13(14)18/h10-14,17H,1-9H2.
What are the key properties of 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine?
1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine has a molecular weight of 260.38 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-piperidin-2-ylimidazol-1-yl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine is sourced from PubChem (CID 114704870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).