4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide

C23H32N2O4S — CID 125086247

About 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide

4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide (PubChem CID 125086247) has the molecular formula C23H32N2O4S and a molecular weight of 432.59 g/mol. Its IUPAC name is 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide.

Molecular Properties

• Compound Name: 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide
• PubChem CID: 125086247
• Molecular Formula: C23H32N2O4S
• Molecular Weight: 432.59 g/mol
• Exact Mass: 432.21
• IUPAC Name: 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide
• SMILES: CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)cc1
• InChI: InChI=1S/C23H32N2O4S/c1-8-30(27,28)25(6)19-11-9-18(10-12-19)23(26)24-17(5)21-14-20(15(2)3)22(29-7)13-16(21)4/h9-15,17H,8H2,1-7H3,(H,24,26)/t17-/m1/s1
• InChIKey: UZLYQIRYCIATJQ-QGZVFWFLSA-N
• XLogP: 4.40
• TPSA: 75.71 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	432.59
LogP ≤ 5	4.40
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide?

The IUPAC name of 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide (CID 125086247) is 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide.

What is the SMILES notation for 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide?

The canonical SMILES for 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide is CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)cc1.

What is the InChIKey of 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide?

The InChIKey is UZLYQIRYCIATJQ-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H32N2O4S/c1-8-30(27,28)25(6)19-11-9-18(10-12-19)23(26)24-17(5)21-14-20(15(2)3)22(29-7)13-16(21)4/h9-15,17H,8H2,1-7H3,(H,24,26)/t17-/m1/s1.

What are the key properties of 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide?

4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide has a molecular weight of 432.59 g/mol, XLogP of 4.40, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[ethylsulfonyl(methyl)amino]-N-[(1R)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]benzamide is sourced from PubChem (CID 125086247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).