N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide

C19H26N6O2 — CID 129006000

About N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide

N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide (PubChem CID 129006000) has the molecular formula C19H26N6O2 and a molecular weight of 370.46 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide.

Molecular Properties

• Compound Name: N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide
• PubChem CID: 129006000
• Molecular Formula: C19H26N6O2
• Molecular Weight: 370.46 g/mol
• Exact Mass: 370.21
• IUPAC Name: N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide
• SMILES: Cc1cc(NC(=O)N2CCC(Oc3cccnc3N3CCCC3)C2)nn1C
• InChI: InChI=1S/C19H26N6O2/c1-14-12-17(22-23(14)2)21-19(26)25-11-7-15(13-25)27-16-6-5-8-20-18(16)24-9-3-4-10-24/h5-6,8,12,15H,3-4,7,9-11,13H2,1-2H3,(H,21,22,26)
• InChIKey: UPWKADLMDYOJLR-UHFFFAOYSA-N
• XLogP: 2.41
• TPSA: 75.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	370.46
LogP ≤ 5	2.41
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide?

The IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide (CID 129006000) is N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide.

What is the SMILES notation for N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide?

The canonical SMILES for N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide is Cc1cc(NC(=O)N2CCC(Oc3cccnc3N3CCCC3)C2)nn1C.

What is the InChIKey of N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide?

The InChIKey is UPWKADLMDYOJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O2/c1-14-12-17(22-23(14)2)21-19(26)25-11-7-15(13-25)27-16-6-5-8-20-18(16)24-9-3-4-10-24/h5-6,8,12,15H,3-4,7,9-11,13H2,1-2H3,(H,21,22,26).

What are the key properties of N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide?

N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide has a molecular weight of 370.46 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(1,5-dimethylpyrazol-3-yl)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidine-1-carboxamide is sourced from PubChem (CID 129006000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).