2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol

C14H22N4O — CID 103993421

About 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol

2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol (PubChem CID 103993421) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol.

Molecular Properties

• Compound Name: 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol
• PubChem CID: 103993421
• Molecular Formula: C14H22N4O
• Molecular Weight: 262.36 g/mol
• Exact Mass: 262.18
• IUPAC Name: 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol
• SMILES: Cc1cc2ncc(CNC(C)(C)C(C)(C)O)cn2n1
• InChI: InChI=1S/C14H22N4O/c1-10-6-12-15-7-11(9-18(12)17-10)8-16-13(2,3)14(4,5)19/h6-7,9,16,19H,8H2,1-5H3
• InChIKey: SBOYUYBVKJPRGN-UHFFFAOYSA-N
• XLogP: 1.68
• TPSA: 62.45 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 19
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	262.36
LogP ≤ 5	1.68
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol?

The IUPAC name of 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol (CID 103993421) is 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol.

What is the SMILES notation for 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol?

The canonical SMILES for 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol is Cc1cc2ncc(CNC(C)(C)C(C)(C)O)cn2n1.

What is the InChIKey of 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol?

The InChIKey is SBOYUYBVKJPRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-6-12-15-7-11(9-18(12)17-10)8-16-13(2,3)14(4,5)19/h6-7,9,16,19H,8H2,1-5H3.

What are the key properties of 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol?

2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol has a molecular weight of 262.36 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2,3-dimethyl-3-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]butan-2-ol is sourced from PubChem (CID 103993421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).