1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone

C19H20N4O — CID 162173166

IUPAC1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone
SMILESCN(C)c1ccc(-c2cccc3nc(CC(=O)C4CC4)nn23)cc1
InChIInChI=1S/C19H20N4O/c1-22(2)15-10-8-13(9-11-15)16-4-3-5-19-20-18(21-23(16)19)12-17(24)14-6-7-14/h3-5,8-11,14H,6-7,12H2,1-2H3
InChIKeyZOBAHLOMHNVXFE-UHFFFAOYSA-N
MW320.40 g/mol
LogP2.98
Rot. Bonds5

About 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone

1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone (PubChem CID 162173166) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone.

Molecular Properties

Compound Name1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone
PubChem CID162173166
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone
SMILESCN(C)c1ccc(-c2cccc3nc(CC(=O)C4CC4)nn23)cc1
InChIInChI=1S/C19H20N4O/c1-22(2)15-10-8-13(9-11-15)16-4-3-5-19-20-18(21-23(16)19)12-17(24)14-6-7-14/h3-5,8-11,14H,6-7,12H2,1-2H3
InChIKeyZOBAHLOMHNVXFE-UHFFFAOYSA-N
XLogP2.98
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone 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-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone?
The IUPAC name of 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone (CID 162173166) is 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone.
What is the SMILES notation for 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone?
The canonical SMILES for 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone is CN(C)c1ccc(-c2cccc3nc(CC(=O)C4CC4)nn23)cc1.
What is the InChIKey of 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone?
The InChIKey is ZOBAHLOMHNVXFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-22(2)15-10-8-13(9-11-15)16-4-3-5-19-20-18(21-23(16)19)12-17(24)14-6-7-14/h3-5,8-11,14H,6-7,12H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone?
1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone has a molecular weight of 320.40 g/mol, XLogP of 2.98, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[5-[4-(dimethylamino)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethanone is sourced from PubChem (CID 162173166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).