8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane

C16H31N3 — CID 155218366

IUPAC8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane
SMILESCN1CCC(CN2CCC3(CCN(C)CC3)C2)CC1
InChIInChI=1S/C16H31N3/c1-17-8-3-15(4-9-17)13-19-12-7-16(14-19)5-10-18(2)11-6-16/h15H,3-14H2,1-2H3
InChIKeyOJQNWCDNUXLGSH-UHFFFAOYSA-N
MW265.44 g/mol
LogP1.75
Rot. Bonds2

About 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane

8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane (PubChem CID 155218366) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane
PubChem CID155218366
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC Name8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane
SMILESCN1CCC(CN2CCC3(CCN(C)CC3)C2)CC1
InChIInChI=1S/C16H31N3/c1-17-8-3-15(4-9-17)13-19-12-7-16(14-19)5-10-18(2)11-6-16/h15H,3-14H2,1-2H3
InChIKeyOJQNWCDNUXLGSH-UHFFFAOYSA-N
XLogP1.75
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane (CID 155218366) is 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane is CN1CCC(CN2CCC3(CCN(C)CC3)C2)CC1.
What is the InChIKey of 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane?
The InChIKey is OJQNWCDNUXLGSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-17-8-3-15(4-9-17)13-19-12-7-16(14-19)5-10-18(2)11-6-16/h15H,3-14H2,1-2H3.
What are the key properties of 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane?
8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane has a molecular weight of 265.44 g/mol, XLogP of 1.75, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 155218366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).