8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane

C15H24N4 — CID 72936007

IUPAC8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane
SMILESCc1cnc(N2CCCC3(CCCN(C)C3)C2)nc1
InChIInChI=1S/C15H24N4/c1-13-9-16-14(17-10-13)19-8-4-6-15(12-19)5-3-7-18(2)11-15/h9-10H,3-8,11-12H2,1-2H3
InChIKeyNUQIPYXPAHNBNY-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.10
Rot. Bonds1

About 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane

8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane (PubChem CID 72936007) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane
PubChem CID72936007
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane
SMILESCc1cnc(N2CCCC3(CCCN(C)C3)C2)nc1
InChIInChI=1S/C15H24N4/c1-13-9-16-14(17-10-13)19-8-4-6-15(12-19)5-3-7-18(2)11-15/h9-10H,3-8,11-12H2,1-2H3
InChIKeyNUQIPYXPAHNBNY-UHFFFAOYSA-N
XLogP2.10
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane?
The IUPAC name of 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane (CID 72936007) is 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane.
What is the SMILES notation for 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane?
The canonical SMILES for 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane is Cc1cnc(N2CCCC3(CCCN(C)C3)C2)nc1.
What is the InChIKey of 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane?
The InChIKey is NUQIPYXPAHNBNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-13-9-16-14(17-10-13)19-8-4-6-15(12-19)5-3-7-18(2)11-15/h9-10H,3-8,11-12H2,1-2H3.
What are the key properties of 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane?
8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane has a molecular weight of 260.38 g/mol, XLogP of 2.10, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-(5-methylpyrimidin-2-yl)-2,8-diazaspiro[5.5]undecane is sourced from PubChem (CID 72936007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).