N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide

C20H28N4O3 — CID 87015170

About N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide

N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide (PubChem CID 87015170) has the molecular formula C20H28N4O3 and a molecular weight of 372.47 g/mol. Its IUPAC name is N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide.

Molecular Properties

• Compound Name: N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide
• PubChem CID: 87015170
• Molecular Formula: C20H28N4O3
• Molecular Weight: 372.47 g/mol
• Exact Mass: 372.22
• IUPAC Name: N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide
• SMILES: Cc1cc(CN2CCN(CC(=O)N(Cc3ccc(C)o3)C3CC3)CC2)on1
• InChI: InChI=1S/C20H28N4O3/c1-15-11-19(27-21-15)12-22-7-9-23(10-8-22)14-20(25)24(17-4-5-17)13-18-6-3-16(2)26-18/h3,6,11,17H,4-5,7-10,12-14H2,1-2H3
• InChIKey: YYBHXUJGFAJOSD-UHFFFAOYSA-N
• XLogP: 2.19
• TPSA: 65.96 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.47
LogP ≤ 5	2.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide?

The IUPAC name of N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide (CID 87015170) is N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide.

What is the SMILES notation for N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide?

The canonical SMILES for N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide is Cc1cc(CN2CCN(CC(=O)N(Cc3ccc(C)o3)C3CC3)CC2)on1.

What is the InChIKey of N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide?

The InChIKey is YYBHXUJGFAJOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O3/c1-15-11-19(27-21-15)12-22-7-9-23(10-8-22)14-20(25)24(17-4-5-17)13-18-6-3-16(2)26-18/h3,6,11,17H,4-5,7-10,12-14H2,1-2H3.

What are the key properties of N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide?

N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide has a molecular weight of 372.47 g/mol, XLogP of 2.19, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 87015170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).