(2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide

C19H20N4O2S — CID 7879245

About (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide

(2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide (PubChem CID 7879245) has the molecular formula C19H20N4O2S and a molecular weight of 368.46 g/mol. Its IUPAC name is (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide.

Molecular Properties

• Compound Name: (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide
• PubChem CID: 7879245
• Molecular Formula: C19H20N4O2S
• Molecular Weight: 368.46 g/mol
• Exact Mass: 368.13
• IUPAC Name: (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide
• SMILES: CC(C)c1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3cccnc3)o2)cc1
• InChI: InChI=1S/C19H20N4O2S/c1-12(2)14-6-8-16(9-7-14)21-17(24)13(3)26-19-23-22-18(25-19)15-5-4-10-20-11-15/h4-13H,1-3H3,(H,21,24)/t13-/m1/s1
• InChIKey: CWGUHKWNERENPQ-CYBMUJFWSA-N
• XLogP: 4.37
• TPSA: 80.91 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	368.46
LogP ≤ 5	4.37
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide?

The IUPAC name of (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide (CID 7879245) is (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide.

What is the SMILES notation for (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide?

The canonical SMILES for (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide is CC(C)c1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3cccnc3)o2)cc1.

What is the InChIKey of (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide?

The InChIKey is CWGUHKWNERENPQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H20N4O2S/c1-12(2)14-6-8-16(9-7-14)21-17(24)13(3)26-19-23-22-18(25-19)15-5-4-10-20-11-15/h4-13H,1-3H3,(H,21,24)/t13-/m1/s1.

What are the key properties of (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide?

(2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide has a molecular weight of 368.46 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-N-(4-propan-2-ylphenyl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide is sourced from PubChem (CID 7879245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).