2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide

C19H25N5O2 — CID 167924107

About 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide

2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide (PubChem CID 167924107) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide
• PubChem CID: 167924107
• Molecular Formula: C19H25N5O2
• Molecular Weight: 355.44 g/mol
• Exact Mass: 355.20
• IUPAC Name: 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide
• SMILES: Cc1cc(C(=O)NC2CCN(C(=O)c3cc(C(C)C)[nH]n3)C2)cc(C)n1
• InChI: InChI=1S/C19H25N5O2/c1-11(2)16-9-17(23-22-16)19(26)24-6-5-15(10-24)21-18(25)14-7-12(3)20-13(4)8-14/h7-9,11,15H,5-6,10H2,1-4H3,(H,21,25)(H,22,23)
• InChIKey: FTIWTUIWJIBJDW-UHFFFAOYSA-N
• XLogP: 2.19
• TPSA: 90.98 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	355.44
LogP ≤ 5	2.19
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide?

The IUPAC name of 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide (CID 167924107) is 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide.

What is the SMILES notation for 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide?

The canonical SMILES for 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide is Cc1cc(C(=O)NC2CCN(C(=O)c3cc(C(C)C)[nH]n3)C2)cc(C)n1.

What is the InChIKey of 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide?

The InChIKey is FTIWTUIWJIBJDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-11(2)16-9-17(23-22-16)19(26)24-6-5-15(10-24)21-18(25)14-7-12(3)20-13(4)8-14/h7-9,11,15H,5-6,10H2,1-4H3,(H,21,25)(H,22,23).

What are the key properties of 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide?

2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-dimethyl-N-[1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]pyridine-4-carboxamide is sourced from PubChem (CID 167924107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).