N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide

C₁₄H₂₂N₂O₄S₂ — CID 110285618

About N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide

N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide (PubChem CID 110285618) has the molecular formula C₁₄H₂₂N₂O₄S₂ and a molecular weight of 346.47 g/mol. Its IUPAC name is N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide.

Molecular Properties

• Compound Name: N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide
• PubChem CID: 110285618
• Molecular Formula: C₁₄H₂₂N₂O₄S₂
• Molecular Weight: 346.47 g/mol
• Exact Mass: 346.10
• IUPAC Name: N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide
• SMILES: CC(C)C[C@H](NS(=O)(=O)c1cccs1)C(=O)N1CCOCC1
• InChI: InChI=1S/C14H22N2O4S2/c1-11(2)10-12(14(17)16-5-7-20-8-6-16)15-22(18,19)13-4-3-9-21-13/h3-4,9,11-12,15H,5-8,10H2,1-2H3/t12-/m0/s1
• InChIKey: ZFALFIQUZVKSSU-LBPRGKRZSA-N
• XLogP: 1.30
• TPSA: 75.71 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	346.47
LogP ≤ 5	1.30
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide?

The IUPAC name of N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide (CID 110285618) is N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide.

What is the SMILES notation for N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide?

The canonical SMILES for N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide is CC(C)C[C@H](NS(=O)(=O)c1cccs1)C(=O)N1CCOCC1.

What is the InChIKey of N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide?

The InChIKey is ZFALFIQUZVKSSU-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H22N2O4S2/c1-11(2)10-12(14(17)16-5-7-20-8-6-16)15-22(18,19)13-4-3-9-21-13/h3-4,9,11-12,15H,5-8,10H2,1-2H3/t12-/m0/s1.

What are the key properties of N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide?

N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide has a molecular weight of 346.47 g/mol, XLogP of 1.30, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2S)-4-methyl-1-morpholin-4-yl-1-oxopentan-2-yl]thiophene-2-sulfonamide is sourced from PubChem (CID 110285618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 110285618 — identifiers, structure, computed properties (public domain)

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