N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

C20H19N3O3S — CID 42793691

About N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 42793691) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

• Compound Name: N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
• PubChem CID: 42793691
• Molecular Formula: C20H19N3O3S
• Molecular Weight: 381.46 g/mol
• Exact Mass: 381.11
• IUPAC Name: N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
• SMILES: O=C(c1cnc2n(c1=O)CCS2)N(CCc1ccccc1)Cc1ccco1
• InChI: InChI=1S/C20H19N3O3S/c24-18(17-13-21-20-23(19(17)25)10-12-27-20)22(14-16-7-4-11-26-16)9-8-15-5-2-1-3-6-15/h1-7,11,13H,8-10,12,14H2
• InChIKey: HRTAWYHNTNRZFI-UHFFFAOYSA-N
• XLogP: 2.83
• TPSA: 68.34 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	381.46
LogP ≤ 5	2.83
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?

The IUPAC name of N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CID 42793691) is N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

What is the SMILES notation for N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?

The canonical SMILES for N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is O=C(c1cnc2n(c1=O)CCS2)N(CCc1ccccc1)Cc1ccco1.

What is the InChIKey of N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?

The InChIKey is HRTAWYHNTNRZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c24-18(17-13-21-20-23(19(17)25)10-12-27-20)22(14-16-7-4-11-26-16)9-8-15-5-2-1-3-6-15/h1-7,11,13H,8-10,12,14H2.

What are the key properties of N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?

N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 381.46 g/mol, XLogP of 2.83, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(furan-2-ylmethyl)-5-oxo-N-(2-phenylethyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 42793691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).