5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine

C24H24N10O2 — CID 140979834

About 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine

5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine (PubChem CID 140979834) has the molecular formula C24H24N10O2 and a molecular weight of 484.52 g/mol. Its IUPAC name is 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine.

Molecular Properties

• Compound Name: 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine
• PubChem CID: 140979834
• Molecular Formula: C24H24N10O2
• Molecular Weight: 484.52 g/mol
• Exact Mass: 484.21
• IUPAC Name: 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine
• SMILES: c1cnc(C2(c3ccn[nH]3)C(c3ncc[nH]3)ON(N3CCCC3)C2(c2ccc[nH]2)c2ncco2)nc1
• InChI: InChI=1S/C24H24N10O2/c1-2-15-33(14-1)34-24(18-5-3-7-25-18,22-30-13-16-35-22)23(17-6-10-31-32-17,21-28-8-4-9-29-21)19(36-34)20-26-11-12-27-20/h3-13,16,19,25H,1-2,14-15H2,(H,26,27)(H,31,32)
• InChIKey: ZLLOHTPSUVJKTJ-UHFFFAOYSA-N
• XLogP: 2.47
• TPSA: 140.67 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 9
• Rotatable Bonds: 6
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	484.52
LogP ≤ 5	2.47
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine?

The IUPAC name of 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine (CID 140979834) is 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine.

What is the SMILES notation for 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine?

The canonical SMILES for 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine is c1cnc(C2(c3ccn[nH]3)C(c3ncc[nH]3)ON(N3CCCC3)C2(c2ccc[nH]2)c2ncco2)nc1.

What is the InChIKey of 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine?

The InChIKey is ZLLOHTPSUVJKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N10O2/c1-2-15-33(14-1)34-24(18-5-3-7-25-18,22-30-13-16-35-22)23(17-6-10-31-32-17,21-28-8-4-9-29-21)19(36-34)20-26-11-12-27-20/h3-13,16,19,25H,1-2,14-15H2,(H,26,27)(H,31,32).

What are the key properties of 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine?

5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine has a molecular weight of 484.52 g/mol, XLogP of 2.47, 6 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(1H-imidazol-2-yl)-3-(1,3-oxazol-2-yl)-4-(1H-pyrazol-5-yl)-4-pyrimidin-2-yl-2-pyrrolidin-1-yl-3-(1H-pyrrol-2-yl)-1,2-oxazolidine is sourced from PubChem (CID 140979834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).