4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide

C19H24N8O4 — CID 67968015

IUPAC4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide
SMILESCN(CCO)C(=O)c1cnn(C)c1C(=O)Nc1ccn2nc(N3CCOCC3)nc2c1
InChIInChI=1S/C19H24N8O4/c1-24(5-8-28)18(30)14-12-20-25(2)16(14)17(29)21-13-3-4-27-15(11-13)22-19(23-27)26-6-9-31-10-7-26/h3-4,11-12,28H,5-10H2,1-2H3,(H,21,29)
InChIKeyVBVBIIOFPFAGOO-UHFFFAOYSA-N
MW428.45 g/mol
LogP-0.38
Rot. Bonds6

About 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide

4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide (PubChem CID 67968015) has the molecular formula C19H24N8O4 and a molecular weight of 428.45 g/mol. Its IUPAC name is 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide.

Molecular Properties

Compound Name4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide
PubChem CID67968015
Molecular FormulaC19H24N8O4
Molecular Weight428.45 g/mol
Exact Mass428.19
IUPAC Name4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide
SMILESCN(CCO)C(=O)c1cnn(C)c1C(=O)Nc1ccn2nc(N3CCOCC3)nc2c1
InChIInChI=1S/C19H24N8O4/c1-24(5-8-28)18(30)14-12-20-25(2)16(14)17(29)21-13-3-4-27-15(11-13)22-19(23-27)26-6-9-31-10-7-26/h3-4,11-12,28H,5-10H2,1-2H3,(H,21,29)
InChIKeyVBVBIIOFPFAGOO-UHFFFAOYSA-N
XLogP-0.38
TPSA130.12 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.45
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

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Frequently Asked Questions

What is the IUPAC name of 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide?
The IUPAC name of 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide (CID 67968015) is 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide.
What is the SMILES notation for 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide?
The canonical SMILES for 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide is CN(CCO)C(=O)c1cnn(C)c1C(=O)Nc1ccn2nc(N3CCOCC3)nc2c1.
What is the InChIKey of 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide?
The InChIKey is VBVBIIOFPFAGOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N8O4/c1-24(5-8-28)18(30)14-12-20-25(2)16(14)17(29)21-13-3-4-27-15(11-13)22-19(23-27)26-6-9-31-10-7-26/h3-4,11-12,28H,5-10H2,1-2H3,(H,21,29).
What are the key properties of 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide?
4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide has a molecular weight of 428.45 g/mol, XLogP of -0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-hydroxyethyl)-4-N,1-dimethyl-5-N-(2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)pyrazole-4,5-dicarboxamide is sourced from PubChem (CID 67968015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).