8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine

C15H29N3 — CID 139789190

IUPAC8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESNC1CC2CCC(C1)N2CCCN1CCCCC1
InChIInChI=1S/C15H29N3/c16-13-11-14-5-6-15(12-13)18(14)10-4-9-17-7-2-1-3-8-17/h13-15H,1-12,16H2
InChIKeyIQXXRQUZRTUTPK-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.82
Rot. Bonds4

About 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine

8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 139789190) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID139789190
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESNC1CC2CCC(C1)N2CCCN1CCCCC1
InChIInChI=1S/C15H29N3/c16-13-11-14-5-6-15(12-13)18(14)10-4-9-17-7-2-1-3-8-17/h13-15H,1-12,16H2
InChIKeyIQXXRQUZRTUTPK-UHFFFAOYSA-N
XLogP1.82
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine (CID 139789190) is 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine is NC1CC2CCC(C1)N2CCCN1CCCCC1.
What is the InChIKey of 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is IQXXRQUZRTUTPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c16-13-11-14-5-6-15(12-13)18(14)10-4-9-17-7-2-1-3-8-17/h13-15H,1-12,16H2.
What are the key properties of 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine?
8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 251.42 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 139789190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).