2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane

C25H48N2 — CID 59966463

IUPAC2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane
SMILESCCCC1(CCC)CCC2(CCN(CCCCCN3CCCCC3)C2)CC1
InChIInChI=1S/C25H48N2/c1-3-11-24(12-4-2)13-15-25(16-14-24)17-22-27(23-25)21-10-6-9-20-26-18-7-5-8-19-26/h3-23H2,1-2H3
InChIKeyUKXWUVNGLLBMGG-UHFFFAOYSA-N
MW376.67 g/mol
LogP6.50
Rot. Bonds10

About 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane

2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane (PubChem CID 59966463) has the molecular formula C25H48N2 and a molecular weight of 376.67 g/mol. Its IUPAC name is 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane.

Molecular Properties

Compound Name2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane
PubChem CID59966463
Molecular FormulaC25H48N2
Molecular Weight376.67 g/mol
Exact Mass376.38
IUPAC Name2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane
SMILESCCCC1(CCC)CCC2(CCN(CCCCCN3CCCCC3)C2)CC1
InChIInChI=1S/C25H48N2/c1-3-11-24(12-4-2)13-15-25(16-14-24)17-22-27(23-25)21-10-6-9-20-26-18-7-5-8-19-26/h3-23H2,1-2H3
InChIKeyUKXWUVNGLLBMGG-UHFFFAOYSA-N
XLogP6.50
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.67
LogP ≤ 56.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Atiprimod
CID 129869
SK&F 105685
CID 121957
Atiprimod Dihydrochloride
CID 166556
3-(9-tert-butyl-3-azaspiro[5.5]undec-3-yl)-N,N-dimethyl-1-propanamine
CID 56993
3-(9-tert-butyl-3-azaspiro[5.5]undecan-3-yl)-N, dihydrochloride
CID 54605840
2-(3-(1-Piperidinyl)propyl)-8,8-dipropyl-2-azaspiro(4.5)decane
CID 129872
3-(3-Azaspiro(5.5)undec-3-yl)-N,N-dimethyl-1-propanamine
CID 415698
3-(9,9-dipropyl-3-azaspiro[5.5]undecan-3-yl)-N,N-dimethylpropan-1-amine
CID 9797268
2-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)-N,N-dimethylethanamine
CID 9817615
4-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)-N,N-dimethylbutan-1-amine
CID 9818616
6-(8,8-dipropyl-2-azaspiro[4.5]decan-2-yl)-N,N-dimethylhexan-1-amine
CID 9841350
3-[8,8-bis(2-methylpropyl)-2-azaspiro[4.5]decan-2-yl]-N,N-dimethylpropan-1-amine
CID 9862607

Frequently Asked Questions

What is the IUPAC name of 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane?
The IUPAC name of 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane (CID 59966463) is 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane.
What is the SMILES notation for 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane?
The canonical SMILES for 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane is CCCC1(CCC)CCC2(CCN(CCCCCN3CCCCC3)C2)CC1.
What is the InChIKey of 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane?
The InChIKey is UKXWUVNGLLBMGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H48N2/c1-3-11-24(12-4-2)13-15-25(16-14-24)17-22-27(23-25)21-10-6-9-20-26-18-7-5-8-19-26/h3-23H2,1-2H3.
What are the key properties of 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane?
2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane has a molecular weight of 376.67 g/mol, XLogP of 6.50, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-piperidin-1-ylpentyl)-8,8-dipropyl-2-azaspiro[4.5]decane is sourced from PubChem (CID 59966463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).