4-methoxy-N-phenylbenzenesulfonamide

C13H13NO3S — CID 835273

IUPAC4-methoxy-N-phenylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2)cc1
InChIInChI=1S/C13H13NO3S/c1-17-12-7-9-13(10-8-12)18(15,16)14-11-5-3-2-4-6-11/h2-10,14H,1H3
InChIKeyGXQBXHZUPPDPLY-UHFFFAOYSA-N
MW263.32 g/mol
LogP2.50
Rot. Bonds4

About 4-methoxy-N-phenylbenzenesulfonamide

4-methoxy-N-phenylbenzenesulfonamide (PubChem CID 835273) has the molecular formula C13H13NO3S and a molecular weight of 263.32 g/mol. Its IUPAC name is 4-methoxy-N-phenylbenzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-phenylbenzenesulfonamide
PubChem CID835273
Molecular FormulaC13H13NO3S
Molecular Weight263.32 g/mol
Exact Mass263.06
IUPAC Name4-methoxy-N-phenylbenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2)cc1
InChIInChI=1S/C13H13NO3S/c1-17-12-7-9-13(10-8-12)18(15,16)14-11-5-3-2-4-6-11/h2-10,14H,1H3
InChIKeyGXQBXHZUPPDPLY-UHFFFAOYSA-N
XLogP2.50
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-anilinophenyl)-4-methoxybenzenesulfonamide
CID 1011074
4-chloro-N-(4-methoxyphenyl)benzenesulfonamide
CID 722849
(2R)-2-(4-methoxyphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 41479035
N-benzyl-4-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzenesulfonamide
CID 1025614
4-(benzenesulfonamido)-N-phenylbenzenesulfonamide
CID 1333712
4-ethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4202178
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 1092869
4-butoxy-N-phenylbenzenesulfonamide
CID 3597057
N-(4-ethynylphenyl)-4-methoxybenzenesulfonamide
CID 102481786
4-methoxy-N-(3-methylsulfanylphenyl)benzenesulfonamide
CID 836468
3-[[4-[(4-methoxyphenyl)sulfamoyl]phenyl]sulfamoyl]benzoic acid
CID 2414183
4-methoxy-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzenesulfonamide
CID 1203751

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-phenylbenzenesulfonamide?
The IUPAC name of 4-methoxy-N-phenylbenzenesulfonamide (CID 835273) is 4-methoxy-N-phenylbenzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-phenylbenzenesulfonamide?
The canonical SMILES for 4-methoxy-N-phenylbenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccccc2)cc1.
What is the InChIKey of 4-methoxy-N-phenylbenzenesulfonamide?
The InChIKey is GXQBXHZUPPDPLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO3S/c1-17-12-7-9-13(10-8-12)18(15,16)14-11-5-3-2-4-6-11/h2-10,14H,1H3.
What are the key properties of 4-methoxy-N-phenylbenzenesulfonamide?
4-methoxy-N-phenylbenzenesulfonamide has a molecular weight of 263.32 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-phenylbenzenesulfonamide is sourced from PubChem (CID 835273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).