8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane

C15H24N4 — CID 64946365

IUPAC8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane
SMILESCc1nccc(CN2CC3(CCCC3)NCC2C)n1
InChIInChI=1S/C15H24N4/c1-12-9-17-15(6-3-4-7-15)11-19(12)10-14-5-8-16-13(2)18-14/h5,8,12,17H,3-4,6-7,9-11H2,1-2H3
InChIKeyBTPXHDWDYKSHTJ-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.89
Rot. Bonds2

About 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane

8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane (PubChem CID 64946365) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane
PubChem CID64946365
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane
SMILESCc1nccc(CN2CC3(CCCC3)NCC2C)n1
InChIInChI=1S/C15H24N4/c1-12-9-17-15(6-3-4-7-15)11-19(12)10-14-5-8-16-13(2)18-14/h5,8,12,17H,3-4,6-7,9-11H2,1-2H3
InChIKeyBTPXHDWDYKSHTJ-UHFFFAOYSA-N
XLogP1.89
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-ethyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 64946171
3-methyl-4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazaspiro[5.5]undecane
CID 64947932
2-methyl-4-[(3-methyl-1,4-diazaspiro[5.5]undecan-4-yl)methyl]-1,3-thiazole
CID 64948404
8-methyl-9-[(1-methylpyrazol-3-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 82871467
10-[(2-methylpyrimidin-4-yl)methyl]-6,10-diazaspiro[4.6]undecane
CID 64949153
4-methyl-2-[(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)methyl]-1,3-thiazole
CID 64945713
3-methyl-4-[(2-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane
CID 64877988
4-[(5,5-dimethyl-2-propan-2-ylpiperazin-1-yl)methyl]-2-methylpyrimidine
CID 64945782
8-methyl-9-(thiophen-3-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64876781
8-methyl-9-(2-pyridin-4-ylethyl)-6,9-diazaspiro[4.5]decane
CID 64933810
9-[(2,3-difluorophenyl)methyl]-8-methyl-6,9-diazaspiro[4.5]decane
CID 64877544
9-[(4,5-dimethylthiophen-2-yl)methyl]-8-methyl-6,9-diazaspiro[4.5]decane
CID 65245286

Frequently Asked Questions

What is the IUPAC name of 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane (CID 64946365) is 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane is Cc1nccc(CN2CC3(CCCC3)NCC2C)n1.
What is the InChIKey of 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane?
The InChIKey is BTPXHDWDYKSHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-12-9-17-15(6-3-4-7-15)11-19(12)10-14-5-8-16-13(2)18-14/h5,8,12,17H,3-4,6-7,9-11H2,1-2H3.
What are the key properties of 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane?
8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane has a molecular weight of 260.38 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-9-[(2-methylpyrimidin-4-yl)methyl]-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64946365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).