4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide

C17H17N7O2 — CID 165415361

IUPAC4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide
SMILESCn1ncc(C(=O)N2CCC2)c1C(=O)Nc1ccnn1-c1ccccn1
InChIInChI=1S/C17H17N7O2/c1-22-15(12(11-20-22)17(26)23-9-4-10-23)16(25)21-14-6-8-19-24(14)13-5-2-3-7-18-13/h2-3,5-8,11H,4,9-10H2,1H3,(H,21,25)
InChIKeyGCSCEGSSRQIIEH-UHFFFAOYSA-N
MW351.37 g/mol
LogP1.10
Rot. Bonds4

About 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide

4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide (PubChem CID 165415361) has the molecular formula C17H17N7O2 and a molecular weight of 351.37 g/mol. Its IUPAC name is 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide
PubChem CID165415361
Molecular FormulaC17H17N7O2
Molecular Weight351.37 g/mol
Exact Mass351.14
IUPAC Name4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide
SMILESCn1ncc(C(=O)N2CCC2)c1C(=O)Nc1ccnn1-c1ccccn1
InChIInChI=1S/C17H17N7O2/c1-22-15(12(11-20-22)17(26)23-9-4-10-23)16(25)21-14-6-8-19-24(14)13-5-2-3-7-18-13/h2-3,5-8,11H,4,9-10H2,1H3,(H,21,25)
InChIKeyGCSCEGSSRQIIEH-UHFFFAOYSA-N
XLogP1.10
TPSA97.94 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.37
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide 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 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide?
The IUPAC name of 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide (CID 165415361) is 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide?
The canonical SMILES for 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide is Cn1ncc(C(=O)N2CCC2)c1C(=O)Nc1ccnn1-c1ccccn1.
What is the InChIKey of 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide?
The InChIKey is GCSCEGSSRQIIEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N7O2/c1-22-15(12(11-20-22)17(26)23-9-4-10-23)16(25)21-14-6-8-19-24(14)13-5-2-3-7-18-13/h2-3,5-8,11H,4,9-10H2,1H3,(H,21,25).
What are the key properties of 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide?
4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide has a molecular weight of 351.37 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azetidine-1-carbonyl)-1-methyl-N-(2-pyridin-2-ylpyrazol-3-yl)pyrazole-5-carboxamide is sourced from PubChem (CID 165415361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).