N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C19H26N6O3 — CID 110111026

About N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 110111026) has the molecular formula C19H26N6O3 and a molecular weight of 386.46 g/mol. Its IUPAC name is N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• PubChem CID: 110111026
• Molecular Formula: C19H26N6O3
• Molecular Weight: 386.46 g/mol
• Exact Mass: 386.21
• IUPAC Name: N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• SMILES: CNC(=O)c1cnn2c(C3CCCCN3C(=O)CN3CCOCC3)ccnc12
• InChI: InChI=1S/C19H26N6O3/c1-20-19(27)14-12-22-25-16(5-6-21-18(14)25)15-4-2-3-7-24(15)17(26)13-23-8-10-28-11-9-23/h5-6,12,15H,2-4,7-11,13H2,1H3,(H,20,27)
• InChIKey: VBJBJBGFLDYENH-UHFFFAOYSA-N
• XLogP: 0.47
• TPSA: 92.07 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	386.46
LogP ≤ 5	0.47
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The IUPAC name of N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 110111026) is N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

What is the SMILES notation for N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The canonical SMILES for N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CNC(=O)c1cnn2c(C3CCCCN3C(=O)CN3CCOCC3)ccnc12.

What is the InChIKey of N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The InChIKey is VBJBJBGFLDYENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O3/c1-20-19(27)14-12-22-25-16(5-6-21-18(14)25)15-4-2-3-7-24(15)17(26)13-23-8-10-28-11-9-23/h5-6,12,15H,2-4,7-11,13H2,1H3,(H,20,27).

What are the key properties of N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 386.46 g/mol, XLogP of 0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-7-[1-(2-morpholin-4-ylacetyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 110111026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).