1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea

C19H20N8O2 — CID 164626220

IUPAC1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea
SMILESCOCCn1nccc1-c1nc2ccc(NC(=O)NCc3ccncc3)cn2n1
InChIInChI=1S/C19H20N8O2/c1-29-11-10-26-16(6-9-22-26)18-24-17-3-2-15(13-27(17)25-18)23-19(28)21-12-14-4-7-20-8-5-14/h2-9,13H,10-12H2,1H3,(H2,21,23,28)
InChIKeyJDVBQNXXVMKQMB-UHFFFAOYSA-N
MW392.42 g/mol
LogP1.96
Rot. Bonds7

About 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea

1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea (PubChem CID 164626220) has the molecular formula C19H20N8O2 and a molecular weight of 392.42 g/mol. Its IUPAC name is 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea.

Molecular Properties

Compound Name1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea
PubChem CID164626220
Molecular FormulaC19H20N8O2
Molecular Weight392.42 g/mol
Exact Mass392.17
IUPAC Name1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea
SMILESCOCCn1nccc1-c1nc2ccc(NC(=O)NCc3ccncc3)cn2n1
InChIInChI=1S/C19H20N8O2/c1-29-11-10-26-16(6-9-22-26)18-24-17-3-2-15(13-27(17)25-18)23-19(28)21-12-14-4-7-20-8-5-14/h2-9,13H,10-12H2,1H3,(H2,21,23,28)
InChIKeyJDVBQNXXVMKQMB-UHFFFAOYSA-N
XLogP1.96
TPSA111.26 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.42
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea?
The IUPAC name of 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea (CID 164626220) is 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea.
What is the SMILES notation for 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea?
The canonical SMILES for 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea is COCCn1nccc1-c1nc2ccc(NC(=O)NCc3ccncc3)cn2n1.
What is the InChIKey of 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea?
The InChIKey is JDVBQNXXVMKQMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N8O2/c1-29-11-10-26-16(6-9-22-26)18-24-17-3-2-15(13-27(17)25-18)23-19(28)21-12-14-4-7-20-8-5-14/h2-9,13H,10-12H2,1H3,(H2,21,23,28).
What are the key properties of 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea?
1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea has a molecular weight of 392.42 g/mol, XLogP of 1.96, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-methoxyethyl)pyrazol-3-yl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-3-(pyridin-4-ylmethyl)urea is sourced from PubChem (CID 164626220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).