2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide

C15H22N2O6S — CID 112991374

IUPAC2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide
SMILESCOc1ccc(S(=O)(=O)NCC(=O)NCC2CCCO2)c(OC)c1
InChIInChI=1S/C15H22N2O6S/c1-21-11-5-6-14(13(8-11)22-2)24(19,20)17-10-15(18)16-9-12-4-3-7-23-12/h5-6,8,12,17H,3-4,7,9-10H2,1-2H3,(H,16,18)
InChIKeyWAJOBFBVHQDBCP-UHFFFAOYSA-N
MW358.42 g/mol
LogP0.28
Rot. Bonds8

About 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide

2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide (PubChem CID 112991374) has the molecular formula C15H22N2O6S and a molecular weight of 358.42 g/mol. Its IUPAC name is 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide
PubChem CID112991374
Molecular FormulaC15H22N2O6S
Molecular Weight358.42 g/mol
Exact Mass358.12
IUPAC Name2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide
SMILESCOc1ccc(S(=O)(=O)NCC(=O)NCC2CCCO2)c(OC)c1
InChIInChI=1S/C15H22N2O6S/c1-21-11-5-6-14(13(8-11)22-2)24(19,20)17-10-15(18)16-9-12-4-3-7-23-12/h5-6,8,12,17H,3-4,7,9-10H2,1-2H3,(H,16,18)
InChIKeyWAJOBFBVHQDBCP-UHFFFAOYSA-N
XLogP0.28
TPSA102.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2,4-dimethoxy-N-(oxolan-2-ylmethyl)benzenesulfonamide
CID 19682484
2-[(5-chloro-2-methoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide
CID 112991399
2-(2,4-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)acetamide
CID 46418634
2,4-dimethoxy-N-[4-(oxolan-2-ylmethylamino)phenyl]benzenesulfonamide
CID 112981250
2-[(2-methylphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide
CID 112991400
2,4-dimethoxy-N-[6-(oxolan-2-ylmethylamino)pyridazin-3-yl]benzenesulfonamide
CID 113039856
N-[[(2R)-oxolan-2-yl]methyl]-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]acetamide
CID 1284754
4-(2,4-dimethoxyphenyl)-4-hydroxy-N-(oxolan-2-ylmethyl)butanamide
CID 84556231
2-(benzenesulfonamido)-N-(oxolan-2-ylmethyl)acetamide
CID 2942219
3-(4-methoxyanilino)-N-(oxolan-2-ylmethyl)propanamide
CID 109015917
3,5-dimethoxy-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]benzamide
CID 18160278
2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 112992756

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide?
The IUPAC name of 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide (CID 112991374) is 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide is COc1ccc(S(=O)(=O)NCC(=O)NCC2CCCO2)c(OC)c1.
What is the InChIKey of 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide?
The InChIKey is WAJOBFBVHQDBCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O6S/c1-21-11-5-6-14(13(8-11)22-2)24(19,20)17-10-15(18)16-9-12-4-3-7-23-12/h5-6,8,12,17H,3-4,7,9-10H2,1-2H3,(H,16,18).
What are the key properties of 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide?
2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide has a molecular weight of 358.42 g/mol, XLogP of 0.28, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethoxyphenyl)sulfonylamino]-N-(oxolan-2-ylmethyl)acetamide is sourced from PubChem (CID 112991374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).