2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

C10H13N5O2 — CID 166643233

IUPAC2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
SMILESCc1nc2nc(N3CCOCC3)cc(=O)n2[nH]1
InChIInChI=1S/C10H13N5O2/c1-7-11-10-12-8(6-9(16)15(10)13-7)14-2-4-17-5-3-14/h6H,2-5H2,1H3,(H,11,12,13)
InChIKeyJOGSKNSJLONRSN-UHFFFAOYSA-N
MW235.25 g/mol
LogP-0.44
Rot. Bonds1

About 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one (PubChem CID 166643233) has the molecular formula C10H13N5O2 and a molecular weight of 235.25 g/mol. Its IUPAC name is 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
PubChem CID166643233
Molecular FormulaC10H13N5O2
Molecular Weight235.25 g/mol
Exact Mass235.11
IUPAC Name2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
SMILESCc1nc2nc(N3CCOCC3)cc(=O)n2[nH]1
InChIInChI=1S/C10H13N5O2/c1-7-11-10-12-8(6-9(16)15(10)13-7)14-2-4-17-5-3-14/h6H,2-5H2,1H3,(H,11,12,13)
InChIKeyJOGSKNSJLONRSN-UHFFFAOYSA-N
XLogP-0.44
TPSA75.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one with MolForge

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Related Compounds

2-Morpholino-1,2,4-triazolo[1,5-a]pyrimidin-7(8h)-one
CID 13901888
5-(Morpholin-4-yl)pyrazolo-[1,5-a]pyrimidin-7(4h)-one
CID 166643225
5-(Morpholin-4-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-one
CID 166643226
5-methyl-2-morpholin-4-yl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
CID 5324516
5-[(3R)-3-methylmorpholin-4-yl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 169035121
5-methyl-2-(morpholin-4-ylcarbonyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
CID 6501308
5-methyl-7-(morpholin-4-ylamino)-2H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one
CID 83026459
2-amino-6-(morpholin-4-ylamino)pyrimidin-4(3H)-one
CID 136776204
2-methyl-4-(morpholin-4-ylamino)-1H-pyrimidin-6-one
CID 136976680

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one (CID 166643233) is 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one is Cc1nc2nc(N3CCOCC3)cc(=O)n2[nH]1.
What is the InChIKey of 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
The InChIKey is JOGSKNSJLONRSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2/c1-7-11-10-12-8(6-9(16)15(10)13-7)14-2-4-17-5-3-14/h6H,2-5H2,1H3,(H,11,12,13).
What are the key properties of 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one?
2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one has a molecular weight of 235.25 g/mol, XLogP of -0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-morpholin-4-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 166643233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).