4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane

C15H29N3 — CID 23282628

IUPAC4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane
SMILESCN1CCN(C2CCNCC2)C2(CCCCC2)C1
InChIInChI=1S/C15H29N3/c1-17-11-12-18(14-5-9-16-10-6-14)15(13-17)7-3-2-4-8-15/h14,16H,2-13H2,1H3
InChIKeyPBNUTWGSMQILTP-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.69
Rot. Bonds1

About 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane

4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane (PubChem CID 23282628) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane
PubChem CID23282628
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane
SMILESCN1CCN(C2CCNCC2)C2(CCCCC2)C1
InChIInChI=1S/C15H29N3/c1-17-11-12-18(14-5-9-16-10-6-14)15(13-17)7-3-2-4-8-15/h14,16H,2-13H2,1H3
InChIKeyPBNUTWGSMQILTP-UHFFFAOYSA-N
XLogP1.69
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane (CID 23282628) is 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane is CN1CCN(C2CCNCC2)C2(CCCCC2)C1.
What is the InChIKey of 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane?
The InChIKey is PBNUTWGSMQILTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-17-11-12-18(14-5-9-16-10-6-14)15(13-17)7-3-2-4-8-15/h14,16H,2-13H2,1H3.
What are the key properties of 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane?
4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane has a molecular weight of 251.42 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-piperidin-4-yl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 23282628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).