2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane

C14H22N4 — CID 118639949

IUPAC2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane
SMILESCc1cnc(N2CCCC3(CCN(C)C3)C2)nc1
InChIInChI=1S/C14H22N4/c1-12-8-15-13(16-9-12)18-6-3-4-14(11-18)5-7-17(2)10-14/h8-9H,3-7,10-11H2,1-2H3
InChIKeySILUXNHPXRKHOY-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.71
Rot. Bonds1

About 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane

2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane (PubChem CID 118639949) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane
PubChem CID118639949
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane
SMILESCc1cnc(N2CCCC3(CCN(C)C3)C2)nc1
InChIInChI=1S/C14H22N4/c1-12-8-15-13(16-9-12)18-6-3-4-14(11-18)5-7-17(2)10-14/h8-9H,3-7,10-11H2,1-2H3
InChIKeySILUXNHPXRKHOY-UHFFFAOYSA-N
XLogP1.71
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 ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;7-methyl-2-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[3.5]nonane
CID 171069701
(5R)-2,9-bis(5-fluoropyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 97450270
7-(5-chloro-2-pyridinyl)-2-methyl-2,7-diazaspiro[4.5]decane
CID 56749174
2-(5-methylpyrimidin-2-yl)-7-oxa-2-azaspiro[3.5]nonane
CID 163233608
2-(5-ethylpyrimidin-2-yl)-9-(5-fluoropyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 134077441
2-[5-(iodomethyl)pyrimidin-2-yl]-7-methyl-2,7-diazaspiro[3.5]nonane
CID 155357699
2-methyl-7-(6-propan-2-ylpyrimidin-4-yl)-2,7-diazaspiro[4.5]decane
CID 72930014
7-(5-fluoropyrimidin-2-yl)-2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decane
CID 134080133
[(5S)-2-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decan-7-yl]-thiophen-2-ylmethanone
CID 97450106
5-methyl-2-(4-methylpiperazin-1-yl)pyrimidine;dihydrochloride
CID 171333757
(3R,5S)-N,N-dimethyl-9-(5-methylpyrimidin-2-yl)-2-oxa-9-azaspiro[4.5]decane-3-carboxamide
CID 124521194
5,7-dimethyl-4-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)pyrido[2,3-d]pyrimidine
CID 72905652

Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane?
The IUPAC name of 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane (CID 118639949) is 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane.
What is the SMILES notation for 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane?
The canonical SMILES for 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane is Cc1cnc(N2CCCC3(CCN(C)C3)C2)nc1.
What is the InChIKey of 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane?
The InChIKey is SILUXNHPXRKHOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-12-8-15-13(16-9-12)18-6-3-4-14(11-18)5-7-17(2)10-14/h8-9H,3-7,10-11H2,1-2H3.
What are the key properties of 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane?
2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane has a molecular weight of 246.36 g/mol, XLogP of 1.71, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane is sourced from PubChem (CID 118639949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).