6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane

C14H22N4 — CID 118742199

IUPAC6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane
SMILESCc1cnc(N2CCC3(CCCCN3C)C2)nc1
InChIInChI=1S/C14H22N4/c1-12-9-15-13(16-10-12)18-8-6-14(11-18)5-3-4-7-17(14)2/h9-10H,3-8,11H2,1-2H3
InChIKeyLFDKVMHZLKDYOM-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.85
Rot. Bonds1

About 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane

6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane (PubChem CID 118742199) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane
PubChem CID118742199
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane
SMILESCc1cnc(N2CCC3(CCCCN3C)C2)nc1
InChIInChI=1S/C14H22N4/c1-12-9-15-13(16-10-12)18-8-6-14(11-18)5-3-4-7-17(14)2/h9-10H,3-8,11H2,1-2H3
InChIKeyLFDKVMHZLKDYOM-UHFFFAOYSA-N
XLogP1.85
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(4-Cyclohexyl-butyl)-piperazin-1-yl]-5-fluoro-pyrimidine
CID 15729908
2-[4-(4-Methylcyclohexyl)piperazin-1-yl]pyrimidine
CID 784284
2-[4-(3-Methylcyclopentyl)piperazin-1-yl]pyrimidine
CID 2845194
7-(Cyclobutylmethyl)-2-[(2-methyl-5-pyrimidinyl)methyl]-2,7-diazaspiro[4.5]decane
CID 45193840
7-(Cyclobutylmethyl)-2-[(2-methoxy-5-pyrimidinyl)methyl]-2,7-diazaspiro[4.5]decane
CID 45229858
9-(Cyclohexylmethyl)-2-[(2-methoxypyrimidin-5-yl)methyl]-2,9-diazaspiro[4.5]decane
CID 45239115
7-(Cyclobutylmethyl)-2-[(2-ethyl-5-pyrimidinyl)methyl]-2,7-diazaspiro[4.5]decane
CID 45252850
N-[(2-ethylpyrimidin-5-yl)methyl]-N-methyl-1-propan-2-ylpiperidin-4-amine
CID 51594519
5-(2,8-diazaspiro[4.5]dec-2-ylmethyl)-N,N-dimethylpyrimidin-2-amine
CID 56712809
5-{[3-(1-Piperidinylmethyl)-1-piperidinyl]methyl}-2-(1-pyrrolidinyl)pyrimidine
CID 70744725
5-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pyrimidin-2-amine
CID 72859157
5-{[rel-(3R,4S)-3-amino-4-cyclopropyl-1-pyrrolidinyl]methyl}-N-ethyl-2-pyrimidinamine dihydrochloride
CID 72860282

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane?
The IUPAC name of 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane (CID 118742199) is 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane.
What is the SMILES notation for 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane?
The canonical SMILES for 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane is Cc1cnc(N2CCC3(CCCCN3C)C2)nc1.
What is the InChIKey of 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane?
The InChIKey is LFDKVMHZLKDYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-12-9-15-13(16-10-12)18-8-6-14(11-18)5-3-4-7-17(14)2/h9-10H,3-8,11H2,1-2H3.
What are the key properties of 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane?
6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane has a molecular weight of 246.36 g/mol, XLogP of 1.85, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(5-methylpyrimidin-2-yl)-2,6-diazaspiro[4.5]decane is sourced from PubChem (CID 118742199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).