2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide

C19H30N4O2 — CID 167869020

About 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide

2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide (PubChem CID 167869020) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide.

Molecular Properties

• Compound Name: 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide
• PubChem CID: 167869020
• Molecular Formula: C19H30N4O2
• Molecular Weight: 346.48 g/mol
• Exact Mass: 346.24
• IUPAC Name: 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide
• SMILES: CC(C)c1cc(C(=O)N2CCC(C)(NC(=O)C(C)C3CCC3)C2)n[nH]1
• InChI: InChI=1S/C19H30N4O2/c1-12(2)15-10-16(22-21-15)18(25)23-9-8-19(4,11-23)20-17(24)13(3)14-6-5-7-14/h10,12-14H,5-9,11H2,1-4H3,(H,20,24)(H,21,22)
• InChIKey: LKEZQZLNBSWKQJ-UHFFFAOYSA-N
• XLogP: 2.69
• TPSA: 78.09 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	346.48
LogP ≤ 5	2.69
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide?

The IUPAC name of 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide (CID 167869020) is 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide.

What is the SMILES notation for 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide?

The canonical SMILES for 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide is CC(C)c1cc(C(=O)N2CCC(C)(NC(=O)C(C)C3CCC3)C2)n[nH]1.

What is the InChIKey of 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide?

The InChIKey is LKEZQZLNBSWKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-12(2)15-10-16(22-21-15)18(25)23-9-8-19(4,11-23)20-17(24)13(3)14-6-5-7-14/h10,12-14H,5-9,11H2,1-4H3,(H,20,24)(H,21,22).

What are the key properties of 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide?

2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide has a molecular weight of 346.48 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclobutyl-N-[3-methyl-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]propanamide is sourced from PubChem (CID 167869020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).