N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide

C20H24N2O3 — CID 94150490

About N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide

N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide (PubChem CID 94150490) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide.

Molecular Properties

• Compound Name: N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide
• PubChem CID: 94150490
• Molecular Formula: C20H24N2O3
• Molecular Weight: 340.42 g/mol
• Exact Mass: 340.18
• IUPAC Name: N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide
• SMILES: C[C@H]1C[C@H]1c1ccc(CN(C)C(=O)CN(C)C(=O)c2ccccc2)o1
• InChI: InChI=1S/C20H24N2O3/c1-14-11-17(14)18-10-9-16(25-18)12-21(2)19(23)13-22(3)20(24)15-7-5-4-6-8-15/h4-10,14,17H,11-13H2,1-3H3/t14-,17+/m0/s1
• InChIKey: LWWIIZVYZHOXBS-WMLDXEAASA-N
• XLogP: 3.13
• TPSA: 53.76 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 6
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	340.42
LogP ≤ 5	3.13
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide?

The IUPAC name of N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide (CID 94150490) is N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide.

What is the SMILES notation for N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide?

The canonical SMILES for N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide is C[C@H]1C[C@H]1c1ccc(CN(C)C(=O)CN(C)C(=O)c2ccccc2)o1.

What is the InChIKey of N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide?

The InChIKey is LWWIIZVYZHOXBS-WMLDXEAASA-N. The full InChI is InChI=1S/C20H24N2O3/c1-14-11-17(14)18-10-9-16(25-18)12-21(2)19(23)13-22(3)20(24)15-7-5-4-6-8-15/h4-10,14,17H,11-13H2,1-3H3/t14-,17+/m0/s1.

What are the key properties of N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide?

N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide has a molecular weight of 340.42 g/mol, XLogP of 3.13, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-N-[2-[methyl-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 94150490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).