1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane

C23H44N2 — CID 57092637

IUPAC1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane
SMILESCCCC1(CCC)CCC2(CCNC2CC(C)N2CCCCC2)CC1
InChIInChI=1S/C23H44N2/c1-4-9-22(10-5-2)11-13-23(14-12-22)15-16-24-21(23)19-20(3)25-17-7-6-8-18-25/h20-21,24H,4-19H2,1-3H3
InChIKeyRTIAZZKBSAUSAO-UHFFFAOYSA-N
MW348.62 g/mol
LogP5.76
Rot. Bonds7

About 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane

1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane (PubChem CID 57092637) has the molecular formula C23H44N2 and a molecular weight of 348.62 g/mol. Its IUPAC name is 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane
PubChem CID57092637
Molecular FormulaC23H44N2
Molecular Weight348.62 g/mol
Exact Mass348.35
IUPAC Name1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane
SMILESCCCC1(CCC)CCC2(CCNC2CC(C)N2CCCCC2)CC1
InChIInChI=1S/C23H44N2/c1-4-9-22(10-5-2)11-13-23(14-12-22)15-16-24-21(23)19-20(3)25-17-7-6-8-18-25/h20-21,24H,4-19H2,1-3H3
InChIKeyRTIAZZKBSAUSAO-UHFFFAOYSA-N
XLogP5.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.62
LogP ≤ 55.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane?
The IUPAC name of 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane (CID 57092637) is 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane.
What is the SMILES notation for 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane?
The canonical SMILES for 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane is CCCC1(CCC)CCC2(CCNC2CC(C)N2CCCCC2)CC1.
What is the InChIKey of 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane?
The InChIKey is RTIAZZKBSAUSAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H44N2/c1-4-9-22(10-5-2)11-13-23(14-12-22)15-16-24-21(23)19-20(3)25-17-7-6-8-18-25/h20-21,24H,4-19H2,1-3H3.
What are the key properties of 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane?
1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane has a molecular weight of 348.62 g/mol, XLogP of 5.76, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane is sourced from PubChem (CID 57092637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).