N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C22H23N5O3 — CID 129284027

About N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 129284027) has the molecular formula C22H23N5O3 and a molecular weight of 405.46 g/mol. Its IUPAC name is N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
• PubChem CID: 129284027
• Molecular Formula: C22H23N5O3
• Molecular Weight: 405.46 g/mol
• Exact Mass: 405.18
• IUPAC Name: N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
• SMILES: CC1(C)Cc2cc(NC(=O)c3cnn4cccnc34)c(N3CCOCC3)cc2C1=O
• InChI: InChI=1S/C22H23N5O3/c1-22(2)12-14-10-17(18(11-15(14)19(22)28)26-6-8-30-9-7-26)25-21(29)16-13-24-27-5-3-4-23-20(16)27/h3-5,10-11,13H,6-9,12H2,1-2H3,(H,25,29)
• InChIKey: GZDUDIFYOWVYPG-UHFFFAOYSA-N
• XLogP: 2.58
• TPSA: 88.83 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	405.46
LogP ≤ 5	2.58
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The IUPAC name of N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 129284027) is N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

What is the SMILES notation for N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The canonical SMILES for N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CC1(C)Cc2cc(NC(=O)c3cnn4cccnc34)c(N3CCOCC3)cc2C1=O.

What is the InChIKey of N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The InChIKey is GZDUDIFYOWVYPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O3/c1-22(2)12-14-10-17(18(11-15(14)19(22)28)26-6-8-30-9-7-26)25-21(29)16-13-24-27-5-3-4-23-20(16)27/h3-5,10-11,13H,6-9,12H2,1-2H3,(H,25,29).

What are the key properties of N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?

N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 405.46 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2,2-dimethyl-6-morpholin-4-yl-1-oxo-3H-inden-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 129284027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).