N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide

C20H19N5O4 — CID 95067710

About N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide

N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide (PubChem CID 95067710) has the molecular formula C20H19N5O4 and a molecular weight of 393.40 g/mol. Its IUPAC name is N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide.

Molecular Properties

• Compound Name: N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide
• PubChem CID: 95067710
• Molecular Formula: C20H19N5O4
• Molecular Weight: 393.40 g/mol
• Exact Mass: 393.14
• IUPAC Name: N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide
• SMILES: CCn1c(=O)c(C)nc2cc(-c3noc([C@@H](C)NC(=O)c4ccco4)n3)ccc21
• InChI: InChI=1S/C20H19N5O4/c1-4-25-15-8-7-13(10-14(15)21-12(3)20(25)27)17-23-19(29-24-17)11(2)22-18(26)16-6-5-9-28-16/h5-11H,4H2,1-3H3,(H,22,26)/t11-/m1/s1
• InChIKey: CQCQUTUXYDEUFC-LLVKDONJSA-N
• XLogP: 2.86
• TPSA: 116.05 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	393.40
LogP ≤ 5	2.86
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide?

The IUPAC name of N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide (CID 95067710) is N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide.

What is the SMILES notation for N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide?

The canonical SMILES for N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide is CCn1c(=O)c(C)nc2cc(-c3noc([C@@H](C)NC(=O)c4ccco4)n3)ccc21.

What is the InChIKey of N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide?

The InChIKey is CQCQUTUXYDEUFC-LLVKDONJSA-N. The full InChI is InChI=1S/C20H19N5O4/c1-4-25-15-8-7-13(10-14(15)21-12(3)20(25)27)17-23-19(29-24-17)11(2)22-18(26)16-6-5-9-28-16/h5-11H,4H2,1-3H3,(H,22,26)/t11-/m1/s1.

What are the key properties of N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide?

N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide has a molecular weight of 393.40 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1R)-1-[3-(1-ethyl-3-methyl-2-oxoquinoxalin-6-yl)-1,2,4-oxadiazol-5-yl]ethyl]furan-2-carboxamide is sourced from PubChem (CID 95067710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).