N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide

C17H19N5O2 — CID 75188084

IUPACN-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)C2CC(c3ccccn3)NN2)cc1
InChIInChI=1S/C17H19N5O2/c1-11(23)19-12-5-7-13(8-6-12)20-17(24)16-10-15(21-22-16)14-4-2-3-9-18-14/h2-9,15-16,21-22H,10H2,1H3,(H,19,23)(H,20,24)
InChIKeyNPCDZZZMCGBSQK-UHFFFAOYSA-N
MW325.37 g/mol
LogP1.59
Rot. Bonds4

About N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide

N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide (PubChem CID 75188084) has the molecular formula C17H19N5O2 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide
PubChem CID75188084
Molecular FormulaC17H19N5O2
Molecular Weight325.37 g/mol
Exact Mass325.15
IUPAC NameN-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)C2CC(c3ccccn3)NN2)cc1
InChIInChI=1S/C17H19N5O2/c1-11(23)19-12-5-7-13(8-6-12)20-17(24)16-10-15(21-22-16)14-4-2-3-9-18-14/h2-9,15-16,21-22H,10H2,1H3,(H,19,23)(H,20,24)
InChIKeyNPCDZZZMCGBSQK-UHFFFAOYSA-N
XLogP1.59
TPSA95.15 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 51.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide (CID 75188084) is N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide is CC(=O)Nc1ccc(NC(=O)C2CC(c3ccccn3)NN2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide?
The InChIKey is NPCDZZZMCGBSQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2/c1-11(23)19-12-5-7-13(8-6-12)20-17(24)16-10-15(21-22-16)14-4-2-3-9-18-14/h2-9,15-16,21-22H,10H2,1H3,(H,19,23)(H,20,24).
What are the key properties of N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide?
N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide has a molecular weight of 325.37 g/mol, XLogP of 1.59, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide is sourced from PubChem (CID 75188084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).