8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine

C19H20N8O — CID 71721683

IUPAC8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
SMILESCn1cc(-c2nccn3nc(Nc4cccc(N5CCOCC5)c4)nc23)cn1
InChIInChI=1S/C19H20N8O/c1-25-13-14(12-21-25)17-18-23-19(24-27(18)6-5-20-17)22-15-3-2-4-16(11-15)26-7-9-28-10-8-26/h2-6,11-13H,7-10H2,1H3,(H,22,24)
InChIKeyQWZXGYFOFVNBFR-UHFFFAOYSA-N
MW376.42 g/mol
LogP2.11
Rot. Bonds4

About 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine

8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine (PubChem CID 71721683) has the molecular formula C19H20N8O and a molecular weight of 376.42 g/mol. Its IUPAC name is 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine.

Molecular Properties

Compound Name8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
PubChem CID71721683
Molecular FormulaC19H20N8O
Molecular Weight376.42 g/mol
Exact Mass376.18
IUPAC Name8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
SMILESCn1cc(-c2nccn3nc(Nc4cccc(N5CCOCC5)c4)nc23)cn1
InChIInChI=1S/C19H20N8O/c1-25-13-14(12-21-25)17-18-23-19(24-27(18)6-5-20-17)22-15-3-2-4-16(11-15)26-7-9-28-10-8-26/h2-6,11-13H,7-10H2,1H3,(H,22,24)
InChIKeyQWZXGYFOFVNBFR-UHFFFAOYSA-N
XLogP2.11
TPSA85.40 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The IUPAC name of 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine (CID 71721683) is 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine.
What is the SMILES notation for 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The canonical SMILES for 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine is Cn1cc(-c2nccn3nc(Nc4cccc(N5CCOCC5)c4)nc23)cn1.
What is the InChIKey of 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
The InChIKey is QWZXGYFOFVNBFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N8O/c1-25-13-14(12-21-25)17-18-23-19(24-27(18)6-5-20-17)22-15-3-2-4-16(11-15)26-7-9-28-10-8-26/h2-6,11-13H,7-10H2,1H3,(H,22,24).
What are the key properties of 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine?
8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine has a molecular weight of 376.42 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-methylpyrazol-4-yl)-N-(3-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyrazin-2-amine is sourced from PubChem (CID 71721683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).