1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol

C19H22N6O2 — CID 50967386

About 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol

1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol (PubChem CID 50967386) has the molecular formula C19H22N6O2 and a molecular weight of 366.43 g/mol. Its IUPAC name is 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol.

Molecular Properties

• Compound Name: 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol
• PubChem CID: 50967386
• Molecular Formula: C19H22N6O2
• Molecular Weight: 366.43 g/mol
• Exact Mass: 366.18
• IUPAC Name: 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol
• SMILES: CN(Cc1cc(-c2ccccn2)no1)c1nccc(N2CCC(O)CC2)n1
• InChI: InChI=1S/C19H22N6O2/c1-24(13-15-12-17(23-27-15)16-4-2-3-8-20-16)19-21-9-5-18(22-19)25-10-6-14(26)7-11-25/h2-5,8-9,12,14,26H,6-7,10-11,13H2,1H3
• InChIKey: FEUADIDZAREMGS-UHFFFAOYSA-N
• XLogP: 2.12
• TPSA: 91.41 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	366.43
LogP ≤ 5	2.12
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol?

The IUPAC name of 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol (CID 50967386) is 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol.

What is the SMILES notation for 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol?

The canonical SMILES for 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol is CN(Cc1cc(-c2ccccn2)no1)c1nccc(N2CCC(O)CC2)n1.

What is the InChIKey of 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol?

The InChIKey is FEUADIDZAREMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2/c1-24(13-15-12-17(23-27-15)16-4-2-3-8-20-16)19-21-9-5-18(22-19)25-10-6-14(26)7-11-25/h2-5,8-9,12,14,26H,6-7,10-11,13H2,1H3.

What are the key properties of 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol?

1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol has a molecular weight of 366.43 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-[methyl-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]amino]pyrimidin-4-yl]piperidin-4-ol is sourced from PubChem (CID 50967386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).