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

C10H16N4O2 — CID 103724996

IUPAC2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione
SMILESCn1nc(NCC2(C)CC2)c(=O)n(C)c1=O
InChIInChI=1S/C10H16N4O2/c1-10(4-5-10)6-11-7-8(15)13(2)9(16)14(3)12-7/h4-6H2,1-3H3,(H,11,12)
InChIKeyLYHLLVKEEJNHBZ-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.31
Rot. Bonds3

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

2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione (PubChem CID 103724996) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione.

Molecular Properties

Compound Name2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione
PubChem CID103724996
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione
SMILESCn1nc(NCC2(C)CC2)c(=O)n(C)c1=O
InChIInChI=1S/C10H16N4O2/c1-10(4-5-10)6-11-7-8(15)13(2)9(16)14(3)12-7/h4-6H2,1-3H3,(H,11,12)
InChIKeyLYHLLVKEEJNHBZ-UHFFFAOYSA-N
XLogP-0.31
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione?
The IUPAC name of 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione (CID 103724996) is 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione.
What is the SMILES notation for 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione?
The canonical SMILES for 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione is Cn1nc(NCC2(C)CC2)c(=O)n(C)c1=O.
What is the InChIKey of 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione?
The InChIKey is LYHLLVKEEJNHBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-10(4-5-10)6-11-7-8(15)13(2)9(16)14(3)12-7/h4-6H2,1-3H3,(H,11,12).
What are the key properties of 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione?
2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione has a molecular weight of 224.26 g/mol, XLogP of -0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-[(1-methylcyclopropyl)methylamino]-1,2,4-triazine-3,5-dione is sourced from PubChem (CID 103724996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).