(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone

C12H15N5O2 — CID 644641

IUPAC(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone
SMILESCc1cc(C)n2nc(C(=O)N3CCOCC3)nc2n1
InChIInChI=1S/C12H15N5O2/c1-8-7-9(2)17-12(13-8)14-10(15-17)11(18)16-3-5-19-6-4-16/h7H,3-6H2,1-2H3
InChIKeyONBHCKYNNVAAEJ-UHFFFAOYSA-N
MW261.28 g/mol
LogP0.21
Rot. Bonds1

About (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone

(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone (PubChem CID 644641) has the molecular formula C12H15N5O2 and a molecular weight of 261.28 g/mol. Its IUPAC name is (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone
PubChem CID644641
Molecular FormulaC12H15N5O2
Molecular Weight261.28 g/mol
Exact Mass261.12
IUPAC Name(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone
SMILESCc1cc(C)n2nc(C(=O)N3CCOCC3)nc2n1
InChIInChI=1S/C12H15N5O2/c1-8-7-9(2)17-12(13-8)14-10(15-17)11(18)16-3-5-19-6-4-16/h7H,3-6H2,1-2H3
InChIKeyONBHCKYNNVAAEJ-UHFFFAOYSA-N
XLogP0.21
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 50.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone with MolForge

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Related Compounds

[2-(Azetidin-1-yl)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
CID 2541003
N-[2-(3,5-Dimethylpyrazol-1-yl)-6-morpholin-4-ylpyrimidin-4-yl]acetamide
CID 25210256
1-(2,6-Dimethylmorpholin-4-yl)-2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]propan-1-one
CID 5166984
2-[(5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-morpholin-4-ylethanone
CID 757646
[2-[Cyclohexyl(methyl)amino]-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
CID 2659053
[2-(3,5-Dimethylpiperidin-1-yl)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
CID 16538511
2-[(5,7-Dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-morpholin-4-ylpropan-1-one
CID 4878112
Ethyl 4-(2,5-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazine-1-carboxylate
CID 5309655
[2-[Bis(2-methylpropyl)amino]-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
CID 2472660
[2-(Cyclohexylamino)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
CID 2659047
[2-[Cyclohexyl(ethyl)amino]-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
CID 7042379
[2-(4-Ethoxycarbonylpiperidin-1-yl)-2-oxoethyl] 5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
CID 9408057

Frequently Asked Questions

What is the IUPAC name of (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone?
The IUPAC name of (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone (CID 644641) is (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone is Cc1cc(C)n2nc(C(=O)N3CCOCC3)nc2n1.
What is the InChIKey of (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone?
The InChIKey is ONBHCKYNNVAAEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2/c1-8-7-9(2)17-12(13-8)14-10(15-17)11(18)16-3-5-19-6-4-16/h7H,3-6H2,1-2H3.
What are the key properties of (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone?
(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone has a molecular weight of 261.28 g/mol, XLogP of 0.21, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 644641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).