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

C14H21N5O — CID 116800123

IUPAC[5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
SMILESCCc1nnc(Oc2cnn(CC)c2)c(CN)c1CC
InChIInChI=1S/C14H21N5O/c1-4-11-12(7-15)14(18-17-13(11)5-2)20-10-8-16-19(6-3)9-10/h8-9H,4-7,15H2,1-3H3
InChIKeyRKCOUZHSAOBICT-UHFFFAOYSA-N
MW275.36 g/mol
LogP2.07
Rot. Bonds6

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

[5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine (PubChem CID 116800123) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is [5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
PubChem CID116800123
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name[5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
SMILESCCc1nnc(Oc2cnn(CC)c2)c(CN)c1CC
InChIInChI=1S/C14H21N5O/c1-4-11-12(7-15)14(18-17-13(11)5-2)20-10-8-16-19(6-3)9-10/h8-9H,4-7,15H2,1-3H3
InChIKeyRKCOUZHSAOBICT-UHFFFAOYSA-N
XLogP2.07
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
CID 116800159
[5-ethyl-6-(1-ethylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 116806797
[3-(2,5-dimethylpyrazol-3-yl)oxy-5,6-diethylpyridazin-4-yl]methanamine
CID 81341711
4-(1-ethylpyrazol-4-yl)oxyaniline
CID 116800266
[5,6-diethyl-3-[(2-methylpropan-2-yl)oxy]pyridazin-4-yl]methanamine
CID 80507981
4-chloro-6-(1-ethylpyrazol-4-yl)oxypyrimidin-5-amine
CID 116800284
[5,6-diethyl-3-(2-fluoro-3-methylphenoxy)pyridazin-4-yl]methanamine
CID 107655134
2-[4-(aminomethyl)-5,6-diethylpyridazin-3-yl]oxyethanol
CID 80507766
[6-(1-ethylpyrazol-4-yl)oxy-2-methyl-3-pyridinyl]methanamine
CID 116802826
[3-(2-bromo-4-fluorophenoxy)-5,6-diethylpyridazin-4-yl]methanamine
CID 80508317
4-(4-bromophenoxy)-1-ethylpyrazole
CID 117229573
4-(1-ethylpyrazol-4-yl)oxybutan-1-amine
CID 116800659

Frequently Asked Questions

What is the IUPAC name of [5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine?
The IUPAC name of [5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine (CID 116800123) is [5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine.
What is the SMILES notation for [5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine?
The canonical SMILES for [5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine is CCc1nnc(Oc2cnn(CC)c2)c(CN)c1CC.
What is the InChIKey of [5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine?
The InChIKey is RKCOUZHSAOBICT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-4-11-12(7-15)14(18-17-13(11)5-2)20-10-8-16-19(6-3)9-10/h8-9H,4-7,15H2,1-3H3.
What are the key properties of [5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine?
[5,6-diethyl-3-(1-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine has a molecular weight of 275.36 g/mol, XLogP of 2.07, 6 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-ethylpyrazol-4-yl)oxypyridazin-4-yl]methanamine is sourced from PubChem (CID 116800123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).