(2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one

C16H25N3O4 — CID 129327146

About (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one

(2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one (PubChem CID 129327146) has the molecular formula C16H25N3O4 and a molecular weight of 323.39 g/mol. Its IUPAC name is (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one.

Molecular Properties

• Compound Name: (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one
• PubChem CID: 129327146
• Molecular Formula: C16H25N3O4
• Molecular Weight: 323.39 g/mol
• Exact Mass: 323.18
• IUPAC Name: (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one
• SMILES: CC(C)c1nnc([C@@H]2CN(C(=O)[C@@H](C)OCC3CC3)CCO2)o1
• InChI: InChI=1S/C16H25N3O4/c1-10(2)14-17-18-15(23-14)13-8-19(6-7-21-13)16(20)11(3)22-9-12-4-5-12/h10-13H,4-9H2,1-3H3/t11-,13+/m1/s1
• InChIKey: QMQWKPMDZXWMDK-YPMHNXCESA-N
• XLogP: 1.91
• TPSA: 77.69 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	323.39
LogP ≤ 5	1.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one?

The IUPAC name of (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one (CID 129327146) is (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one.

What is the SMILES notation for (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one?

The canonical SMILES for (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one is CC(C)c1nnc([C@@H]2CN(C(=O)[C@@H](C)OCC3CC3)CCO2)o1.

What is the InChIKey of (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one?

The InChIKey is QMQWKPMDZXWMDK-YPMHNXCESA-N. The full InChI is InChI=1S/C16H25N3O4/c1-10(2)14-17-18-15(23-14)13-8-19(6-7-21-13)16(20)11(3)22-9-12-4-5-12/h10-13H,4-9H2,1-3H3/t11-,13+/m1/s1.

What are the key properties of (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one?

(2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one has a molecular weight of 323.39 g/mol, XLogP of 1.91, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-2-(cyclopropylmethoxy)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one is sourced from PubChem (CID 129327146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).