N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide

C17H20N6O4 — CID 56739146

About N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide

N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide (PubChem CID 56739146) has the molecular formula C17H20N6O4 and a molecular weight of 372.39 g/mol. Its IUPAC name is N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide.

Molecular Properties

• Compound Name: N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide
• PubChem CID: 56739146
• Molecular Formula: C17H20N6O4
• Molecular Weight: 372.39 g/mol
• Exact Mass: 372.15
• IUPAC Name: N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide
• SMILES: O=C(Nc1ccnn1C1CCN(C(=O)c2c[nH]c(=O)[nH]c2=O)CC1)C1CC1
• InChI: InChI=1S/C17H20N6O4/c24-14(10-1-2-10)20-13-3-6-19-23(13)11-4-7-22(8-5-11)16(26)12-9-18-17(27)21-15(12)25/h3,6,9-11H,1-2,4-5,7-8H2,(H,20,24)(H2,18,21,25,27)
• InChIKey: CBSPGGUHBIVWMG-UHFFFAOYSA-N
• XLogP: 0.09
• TPSA: 132.95 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.39
LogP ≤ 5	0.09
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide?

The IUPAC name of N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide (CID 56739146) is N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide.

What is the SMILES notation for N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide?

The canonical SMILES for N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide is O=C(Nc1ccnn1C1CCN(C(=O)c2c[nH]c(=O)[nH]c2=O)CC1)C1CC1.

What is the InChIKey of N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide?

The InChIKey is CBSPGGUHBIVWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O4/c24-14(10-1-2-10)20-13-3-6-19-23(13)11-4-7-22(8-5-11)16(26)12-9-18-17(27)21-15(12)25/h3,6,9-11H,1-2,4-5,7-8H2,(H,20,24)(H2,18,21,25,27).

What are the key properties of N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide?

N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide has a molecular weight of 372.39 g/mol, XLogP of 0.09, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[1-(2,4-dioxo-1H-pyrimidine-5-carbonyl)piperidin-4-yl]pyrazol-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 56739146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).