4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide

C19H25N7O3 — CID 165415372

IUPAC4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide
SMILESCn1ncc(NC(=O)c2c(C(=O)N3CCC3)cnn2C)c1C(=O)N1CCCCC1
InChIInChI=1S/C19H25N7O3/c1-23-15(13(11-20-23)18(28)25-9-6-10-25)17(27)22-14-12-21-24(2)16(14)19(29)26-7-4-3-5-8-26/h11-12H,3-10H2,1-2H3,(H,22,27)
InChIKeyDLSNEDNTKBYFLZ-UHFFFAOYSA-N
MW399.46 g/mol
LogP0.88
Rot. Bonds4

About 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide

4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide (PubChem CID 165415372) has the molecular formula C19H25N7O3 and a molecular weight of 399.46 g/mol. Its IUPAC name is 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide
PubChem CID165415372
Molecular FormulaC19H25N7O3
Molecular Weight399.46 g/mol
Exact Mass399.20
IUPAC Name4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide
SMILESCn1ncc(NC(=O)c2c(C(=O)N3CCC3)cnn2C)c1C(=O)N1CCCCC1
InChIInChI=1S/C19H25N7O3/c1-23-15(13(11-20-23)18(28)25-9-6-10-25)17(27)22-14-12-21-24(2)16(14)19(29)26-7-4-3-5-8-26/h11-12H,3-10H2,1-2H3,(H,22,27)
InChIKeyDLSNEDNTKBYFLZ-UHFFFAOYSA-N
XLogP0.88
TPSA105.36 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.46
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-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-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide?
The IUPAC name of 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide (CID 165415372) is 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide.
What is the SMILES notation for 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide?
The canonical SMILES for 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide is Cn1ncc(NC(=O)c2c(C(=O)N3CCC3)cnn2C)c1C(=O)N1CCCCC1.
What is the InChIKey of 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide?
The InChIKey is DLSNEDNTKBYFLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N7O3/c1-23-15(13(11-20-23)18(28)25-9-6-10-25)17(27)22-14-12-21-24(2)16(14)19(29)26-7-4-3-5-8-26/h11-12H,3-10H2,1-2H3,(H,22,27).
What are the key properties of 4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide?
4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide has a molecular weight of 399.46 g/mol, XLogP of 0.88, 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-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide is sourced from PubChem (CID 165415372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).