6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine

C12H15N5O — CID 104516646

IUPAC6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine
SMILESCNc1nnc(-c2nccnc2OC)c(C)c1C
InChIInChI=1S/C12H15N5O/c1-7-8(2)11(13-3)17-16-9(7)10-12(18-4)15-6-5-14-10/h5-6H,1-4H3,(H,13,17)
InChIKeyREIFCFKIGOEENI-UHFFFAOYSA-N
MW245.29 g/mol
LogP1.60
Rot. Bonds3

About 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine

6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine (PubChem CID 104516646) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine
PubChem CID104516646
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine
SMILESCNc1nnc(-c2nccnc2OC)c(C)c1C
InChIInChI=1S/C12H15N5O/c1-7-8(2)11(13-3)17-16-9(7)10-12(18-4)15-6-5-14-10/h5-6H,1-4H3,(H,13,17)
InChIKeyREIFCFKIGOEENI-UHFFFAOYSA-N
XLogP1.60
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine?
The IUPAC name of 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine (CID 104516646) is 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine.
What is the SMILES notation for 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine?
The canonical SMILES for 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine is CNc1nnc(-c2nccnc2OC)c(C)c1C.
What is the InChIKey of 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine?
The InChIKey is REIFCFKIGOEENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-7-8(2)11(13-3)17-16-9(7)10-12(18-4)15-6-5-14-10/h5-6H,1-4H3,(H,13,17).
What are the key properties of 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine?
6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine has a molecular weight of 245.29 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxypyrazin-2-yl)-N,4,5-trimethylpyridazin-3-amine is sourced from PubChem (CID 104516646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).