4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine

C10H14N6O2 — CID 81342173

IUPAC4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine
SMILESCCOc1nc(NC)nc(Oc2cc(C)[nH]n2)n1
InChIInChI=1S/C10H14N6O2/c1-4-17-9-12-8(11-3)13-10(14-9)18-7-5-6(2)15-16-7/h5H,4H2,1-3H3,(H,15,16)(H,11,12,13,14)
InChIKeyYOQBJNYSLRAPKR-UHFFFAOYSA-N
MW250.26 g/mol
LogP1.14
Rot. Bonds5

About 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine

4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine (PubChem CID 81342173) has the molecular formula C10H14N6O2 and a molecular weight of 250.26 g/mol. Its IUPAC name is 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine
PubChem CID81342173
Molecular FormulaC10H14N6O2
Molecular Weight250.26 g/mol
Exact Mass250.12
IUPAC Name4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine
SMILESCCOc1nc(NC)nc(Oc2cc(C)[nH]n2)n1
InChIInChI=1S/C10H14N6O2/c1-4-17-9-12-8(11-3)13-10(14-9)18-7-5-6(2)15-16-7/h5H,4H2,1-3H3,(H,15,16)(H,11,12,13,14)
InChIKeyYOQBJNYSLRAPKR-UHFFFAOYSA-N
XLogP1.14
TPSA97.84 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine (CID 81342173) is 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine is CCOc1nc(NC)nc(Oc2cc(C)[nH]n2)n1.
What is the InChIKey of 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine?
The InChIKey is YOQBJNYSLRAPKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O2/c1-4-17-9-12-8(11-3)13-10(14-9)18-7-5-6(2)15-16-7/h5H,4H2,1-3H3,(H,15,16)(H,11,12,13,14).
What are the key properties of 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine?
4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine has a molecular weight of 250.26 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-methyl-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-1,3,5-triazin-2-amine is sourced from PubChem (CID 81342173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).