[5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine

C15H23N5O — CID 116800159

IUPAC[5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
SMILESCCCn1cc(Oc2nnc(CC)c(CC)c2CN)cn1
InChIInChI=1S/C15H23N5O/c1-4-7-20-10-11(9-17-20)21-15-13(8-16)12(5-2)14(6-3)18-19-15/h9-10H,4-8,16H2,1-3H3
InChIKeyNQLUIQMWVAUAMI-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.46
Rot. Bonds7

About [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine

[5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine (PubChem CID 116800159) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
PubChem CID116800159
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name[5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
SMILESCCCn1cc(Oc2nnc(CC)c(CC)c2CN)cn1
InChIInChI=1S/C15H23N5O/c1-4-7-20-10-11(9-17-20)21-15-13(8-16)12(5-2)14(6-3)18-19-15/h9-10H,4-8,16H2,1-3H3
InChIKeyNQLUIQMWVAUAMI-UHFFFAOYSA-N
XLogP2.46
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
CID 116800123
[5-(1-propylpyrazol-4-yl)oxypyrazin-2-yl]methanamine
CID 116800165
[3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine
CID 107056208
[1-(1-propylpyrazol-4-yl)oxyisoquinolin-4-yl]methanamine
CID 106777567
4-methyl-2-(1-propylpyrazol-4-yl)oxypyridin-3-amine
CID 116800363
[3-(2,5-dimethylpyrazol-3-yl)oxy-5,6-diethylpyridazin-4-yl]methanamine
CID 81341711
2-[5-methyl-6-(1-propylpyrazol-4-yl)oxy-3-pyridinyl]ethanamine
CID 116804222
2-(1-propylpyrazol-4-yl)oxybutanamide
CID 116804832
[2-bromo-4-(1-propylpyrazol-4-yl)oxyphenyl]methanamine
CID 107275288
[5-methyl-6-(1-propylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 116806862
[6-(1-propylpyrazol-4-yl)oxypyridazin-3-yl]methanol
CID 116802649
4-propoxy-1-propylpyrazole
CID 116805185

Frequently Asked Questions

What is the IUPAC name of [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine?
The IUPAC name of [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine (CID 116800159) is [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine.
What is the SMILES notation for [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine?
The canonical SMILES for [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine is CCCn1cc(Oc2nnc(CC)c(CC)c2CN)cn1.
What is the InChIKey of [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine?
The InChIKey is NQLUIQMWVAUAMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-4-7-20-10-11(9-17-20)21-15-13(8-16)12(5-2)14(6-3)18-19-15/h9-10H,4-8,16H2,1-3H3.
What are the key properties of [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine?
[5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine has a molecular weight of 289.38 g/mol, XLogP of 2.46, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine is sourced from PubChem (CID 116800159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).