6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone

C10H11N5O2 — CID 47778239

IUPAC6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone
SMILESCc1cc(C(=O)N2CCCn3ncnc32)on1
InChIInChI=1S/C10H11N5O2/c1-7-5-8(17-13-7)9(16)14-3-2-4-15-10(14)11-6-12-15/h5-6H,2-4H2,1H3
InChIKeyDSXMZPZHFRACKD-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.63
Rot. Bonds1

About 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone

6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone (PubChem CID 47778239) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone.

Molecular Properties

Compound Name6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone
PubChem CID47778239
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC Name6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone
SMILESCc1cc(C(=O)N2CCCn3ncnc32)on1
InChIInChI=1S/C10H11N5O2/c1-7-5-8(17-13-7)9(16)14-3-2-4-15-10(14)11-6-12-15/h5-6H,2-4H2,1H3
InChIKeyDSXMZPZHFRACKD-UHFFFAOYSA-N
XLogP0.63
TPSA77.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone with MolForge

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Related Compounds

(3-methyl-1,2-oxazol-5-yl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone
CID 43060282
(3-methyl-1,2-oxazol-5-yl)-(4-methylpiperazin-1-yl)methanone
CID 20868333
methyl 4-(3-methyl-1,2-oxazole-5-carbonyl)piperazine-1-carboxylate
CID 78904854
(3-aminoazetidin-1-yl)-(3-methyl-1,2-oxazol-5-yl)methanone
CID 65244680
(3-hydroxy-3-methylpiperidin-1-yl)-(3-methyl-1,2-oxazol-5-yl)methanone
CID 115874476
[4-(aminomethyl)piperidin-1-yl]-(3-methyl-1,2-oxazol-5-yl)methanone;hydrochloride
CID 119423963
2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl-(3-methyl-1,2-oxazol-5-yl)methanone
CID 75376530
(4-hydroxy-4-methylpiperidin-1-yl)-(3-methyl-1,2-oxazol-5-yl)methanone
CID 80707380
(3,5-dimethylphenyl)-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]methanone
CID 32517272
(3-chloropiperidin-1-yl)-(3-methyl-1,2-oxazol-5-yl)methanone
CID 63392780
1-cyclohexyl-3-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-4-yl]urea
CID 51092058
(3-methyl-1,2-oxazol-5-yl)-[4-(oxan-4-yl)piperazin-1-yl]methanone
CID 136512064

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone?
The IUPAC name of 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone (CID 47778239) is 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone.
What is the SMILES notation for 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone?
The canonical SMILES for 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone is Cc1cc(C(=O)N2CCCn3ncnc32)on1.
What is the InChIKey of 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone?
The InChIKey is DSXMZPZHFRACKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c1-7-5-8(17-13-7)9(16)14-3-2-4-15-10(14)11-6-12-15/h5-6H,2-4H2,1H3.
What are the key properties of 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone?
6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone has a molecular weight of 233.23 g/mol, XLogP of 0.63, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl-(3-methyl-1,2-oxazol-5-yl)methanone is sourced from PubChem (CID 47778239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).