6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine

C18H22N8O — CID 156844954

IUPAC6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine
SMILESCOc1nc(-c2ccc(NC3CCNCC3)nn2)ccc1-c1cnn(C)n1
InChIInChI=1S/C18H22N8O/c1-26-20-11-16(25-26)13-3-4-14(22-18(13)27-2)15-5-6-17(24-23-15)21-12-7-9-19-10-8-12/h3-6,11-12,19H,7-10H2,1-2H3,(H,21,24)
InChIKeyZNIKZBORYDHYAC-UHFFFAOYSA-N
MW366.43 g/mol
LogP1.51
Rot. Bonds5

About 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine

6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine (PubChem CID 156844954) has the molecular formula C18H22N8O and a molecular weight of 366.43 g/mol. Its IUPAC name is 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine.

Molecular Properties

Compound Name6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine
PubChem CID156844954
Molecular FormulaC18H22N8O
Molecular Weight366.43 g/mol
Exact Mass366.19
IUPAC Name6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine
SMILESCOc1nc(-c2ccc(NC3CCNCC3)nn2)ccc1-c1cnn(C)n1
InChIInChI=1S/C18H22N8O/c1-26-20-11-16(25-26)13-3-4-14(22-18(13)27-2)15-5-6-17(24-23-15)21-12-7-9-19-10-8-12/h3-6,11-12,19H,7-10H2,1-2H3,(H,21,24)
InChIKeyZNIKZBORYDHYAC-UHFFFAOYSA-N
XLogP1.51
TPSA102.67 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.43
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine with MolForge

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Related Compounds

6-(5-methylfuran-2-yl)-N-piperidin-4-ylpyridazin-3-amine
CID 116971043
tert-butyl (1R,5S)-3-[[6-[6-methoxy-5-(1-methyltriazol-4-yl)-2-pyridinyl]pyridazin-3-yl]amino]-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 170519243
N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine
CID 116970983
ethane;6-[6-methoxy-5-(1H-pyrazol-4-yl)-2-pyridinyl]-N-methylpyridazin-3-amine
CID 156844905
3-(3,5-dimethoxyphenyl)-N-piperidin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 24865113
6-(2-methylpropyl)-N-piperidin-4-ylpyridazin-3-amine
CID 116971030
N-[6-(1,3-dimethylpyrazol-4-yl)pyridazin-3-yl]-7-azaspiro[3.5]nonan-2-amine;dihydrochloride
CID 138562448
4-methoxy-N-piperidin-4-ylpyridin-2-amine
CID 11458426
2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride
CID 67373203
6-methyl-N-[(3R)-pyrrolidin-3-yl]pyridazin-3-amine;hydrochloride
CID 71638623
N-cyclopropyl-6-(3,4,5-trimethoxyphenyl)pyridazin-3-amine
CID 74249111
N-piperidin-4-yl-2-propan-2-ylpyrimidin-4-amine
CID 83838042

Frequently Asked Questions

What is the IUPAC name of 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine?
The IUPAC name of 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine (CID 156844954) is 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine.
What is the SMILES notation for 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine?
The canonical SMILES for 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine is COc1nc(-c2ccc(NC3CCNCC3)nn2)ccc1-c1cnn(C)n1.
What is the InChIKey of 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine?
The InChIKey is ZNIKZBORYDHYAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N8O/c1-26-20-11-16(25-26)13-3-4-14(22-18(13)27-2)15-5-6-17(24-23-15)21-12-7-9-19-10-8-12/h3-6,11-12,19H,7-10H2,1-2H3,(H,21,24).
What are the key properties of 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine?
6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine has a molecular weight of 366.43 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-methoxy-5-(2-methyltriazol-4-yl)-2-pyridinyl]-N-piperidin-4-ylpyridazin-3-amine is sourced from PubChem (CID 156844954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).