2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide

C17H20N2O4S — CID 91824572

IUPAC2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(C(C)C)cc1S(=O)(=O)Nc1ccccc1C(N)=O
InChIInChI=1S/C17H20N2O4S/c1-11(2)12-8-9-15(23-3)16(10-12)24(21,22)19-14-7-5-4-6-13(14)17(18)20/h4-11,19H,1-3H3,(H2,18,20)
InChIKeyUAYZXTUMVFTJFA-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.72
Rot. Bonds6

About 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide

2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide (PubChem CID 91824572) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide
PubChem CID91824572
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(C(C)C)cc1S(=O)(=O)Nc1ccccc1C(N)=O
InChIInChI=1S/C17H20N2O4S/c1-11(2)12-8-9-15(23-3)16(10-12)24(21,22)19-14-7-5-4-6-13(14)17(18)20/h4-11,19H,1-3H3,(H2,18,20)
InChIKeyUAYZXTUMVFTJFA-UHFFFAOYSA-N
XLogP2.72
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide
CID 91824621
N-(2-cyanophenyl)-2-methoxy-5-propan-2-ylbenzenesulfonamide
CID 110757600
2-[(5-methoxy-2,4-dimethylphenyl)sulfonylamino]benzamide
CID 91824586
methyl 2-[(2-methoxyphenyl)sulfonylamino]benzoate
CID 110757322
3-[(2-methoxyphenyl)sulfonylamino]-2-methylbenzamide
CID 86983204
methyl 2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]benzoate
CID 27242666
2-[(2,5-dimethoxyphenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 51557476
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-(1-phenylethyl)benzamide
CID 133228042
4-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzoic acid
CID 15944042
ethyl 2-[(2-methoxy-5-methylphenyl)sulfonylamino]benzoate
CID 95969690
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide
CID 26268702
N-(2-chlorophenyl)-2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]propanamide
CID 43890485

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide?
The IUPAC name of 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide (CID 91824572) is 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide?
The canonical SMILES for 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide is COc1ccc(C(C)C)cc1S(=O)(=O)Nc1ccccc1C(N)=O.
What is the InChIKey of 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide?
The InChIKey is UAYZXTUMVFTJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-11(2)12-8-9-15(23-3)16(10-12)24(21,22)19-14-7-5-4-6-13(14)17(18)20/h4-11,19H,1-3H3,(H2,18,20).
What are the key properties of 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide?
2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.72, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxy-5-propan-2-ylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 91824572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).