6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide

C24H24N8O — CID 53328988

About 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide

6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide (PubChem CID 53328988) has the molecular formula C24H24N8O and a molecular weight of 440.51 g/mol. Its IUPAC name is 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
• PubChem CID: 53328988
• Molecular Formula: C24H24N8O
• Molecular Weight: 440.51 g/mol
• Exact Mass: 440.21
• IUPAC Name: 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
• SMILES: CC(C)n1nc(-c2ccccn2)cc1NC(=O)c1nc(C2CC2)ccc1Nc1cncnc1
• InChI: InChI=1S/C24H24N8O/c1-15(2)32-22(11-21(31-32)19-5-3-4-10-27-19)30-24(33)23-20(28-17-12-25-14-26-13-17)9-8-18(29-23)16-6-7-16/h3-5,8-16,28H,6-7H2,1-2H3,(H,30,33)
• InChIKey: CWCFYTWMYNKYGR-UHFFFAOYSA-N
• XLogP: 4.58
• TPSA: 110.51 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 7
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	440.51
LogP ≤ 5	4.58
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide?

The IUPAC name of 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide (CID 53328988) is 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide.

What is the SMILES notation for 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide?

The canonical SMILES for 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide is CC(C)n1nc(-c2ccccn2)cc1NC(=O)c1nc(C2CC2)ccc1Nc1cncnc1.

What is the InChIKey of 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide?

The InChIKey is CWCFYTWMYNKYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N8O/c1-15(2)32-22(11-21(31-32)19-5-3-4-10-27-19)30-24(33)23-20(28-17-12-25-14-26-13-17)9-8-18(29-23)16-6-7-16/h3-5,8-16,28H,6-7H2,1-2H3,(H,30,33).

What are the key properties of 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide?

6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide has a molecular weight of 440.51 g/mol, XLogP of 4.58, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 6-cyclopropyl-N-(1-propan-2-yl-3-pyridin-2-ylpyrazol-5-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide is sourced from PubChem (CID 53328988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).