2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone

C16H22N6O2 — CID 124940115

About 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone

2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone (PubChem CID 124940115) has the molecular formula C16H22N6O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone.

Molecular Properties

• Compound Name: 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone
• PubChem CID: 124940115
• Molecular Formula: C16H22N6O2
• Molecular Weight: 330.39 g/mol
• Exact Mass: 330.18
• IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone
• SMILES: CNc1nccnc1[C@H]1CN(C(=O)Cn2nc(C)cc2C)CCO1
• InChI: InChI=1S/C16H22N6O2/c1-11-8-12(2)22(20-11)10-14(23)21-6-7-24-13(9-21)15-16(17-3)19-5-4-18-15/h4-5,8,13H,6-7,9-10H2,1-3H3,(H,17,19)/t13-/m1/s1
• InChIKey: ADZBHJYEVNRWPW-CYBMUJFWSA-N
• XLogP: 0.93
• TPSA: 85.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	330.39
LogP ≤ 5	0.93
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone?

The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone (CID 124940115) is 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone.

What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone?

The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone is CNc1nccnc1[C@H]1CN(C(=O)Cn2nc(C)cc2C)CCO1.

What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone?

The InChIKey is ADZBHJYEVNRWPW-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H22N6O2/c1-11-8-12(2)22(20-11)10-14(23)21-6-7-24-13(9-21)15-16(17-3)19-5-4-18-15/h4-5,8,13H,6-7,9-10H2,1-3H3,(H,17,19)/t13-/m1/s1.

What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone?

2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone has a molecular weight of 330.39 g/mol, XLogP of 0.93, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3,5-dimethylpyrazol-1-yl)-1-[(2R)-2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone is sourced from PubChem (CID 124940115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).