6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione

C11H15N5O3 — CID 78974609

IUPAC6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCc1noc(C)c1CNc1nn(C)c(=O)n(C)c1=O
InChIInChI=1S/C11H15N5O3/c1-6-8(7(2)19-14-6)5-12-9-10(17)15(3)11(18)16(4)13-9/h5H2,1-4H3,(H,12,13)
InChIKeyKENQYYVBYYFATC-UHFFFAOYSA-N
MW265.27 g/mol
LogP-0.30
Rot. Bonds3

About 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione

6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione (PubChem CID 78974609) has the molecular formula C11H15N5O3 and a molecular weight of 265.27 g/mol. Its IUPAC name is 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione.

Molecular Properties

Compound Name6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
PubChem CID78974609
Molecular FormulaC11H15N5O3
Molecular Weight265.27 g/mol
Exact Mass265.12
IUPAC Name6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCc1noc(C)c1CNc1nn(C)c(=O)n(C)c1=O
InChIInChI=1S/C11H15N5O3/c1-6-8(7(2)19-14-6)5-12-9-10(17)15(3)11(18)16(4)13-9/h5H2,1-4H3,(H,12,13)
InChIKeyKENQYYVBYYFATC-UHFFFAOYSA-N
XLogP-0.30
TPSA94.95 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione with MolForge

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Related Compounds

2,4-dimethyl-6-[(2-methyl-1,3-thiazol-5-yl)methylamino]-1,2,4-triazine-3,5-dione
CID 61281036
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one
CID 115657215
4-chloro-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2-(2-methoxyethyl)pyridazin-3-one
CID 115593128
4-bromo-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2-propylpyridazin-3-one
CID 114439954
4-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-N,2-diethyl-5-methylpyrimidine-4,6-diamine
CID 80991919
4,6-dichloro-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,3,5-triazin-2-amine
CID 79237881
6-(2,3-dihydroxypropylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 66177760
6-chloro-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-nitropyrimidin-4-amine
CID 79238315
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]ethanamine
CID 28780717
3-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-fluorobenzene-1,3-diamine
CID 79225193
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-piperidin-1-ylpropan-1-amine
CID 28781392
1-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]methanamine
CID 78989481

Frequently Asked Questions

What is the IUPAC name of 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The IUPAC name of 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione (CID 78974609) is 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione.
What is the SMILES notation for 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The canonical SMILES for 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione is Cc1noc(C)c1CNc1nn(C)c(=O)n(C)c1=O.
What is the InChIKey of 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The InChIKey is KENQYYVBYYFATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O3/c1-6-8(7(2)19-14-6)5-12-9-10(17)15(3)11(18)16(4)13-9/h5H2,1-4H3,(H,12,13).
What are the key properties of 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione has a molecular weight of 265.27 g/mol, XLogP of -0.30, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione is sourced from PubChem (CID 78974609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).