2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide

C14H15N3O3S — CID 43576281

IUPAC2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccccc1NS(=O)(=O)c1ccccc1N
InChIInChI=1S/C14H15N3O3S/c1-16-14(18)10-6-2-4-8-12(10)17-21(19,20)13-9-5-3-7-11(13)15/h2-9,17H,15H2,1H3,(H,16,18)
InChIKeyYSYBBJLEPWEDJZ-UHFFFAOYSA-N
MW305.36 g/mol
LogP1.43
Rot. Bonds4

About 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide

2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide (PubChem CID 43576281) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide.

Molecular Properties

Compound Name2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide
PubChem CID43576281
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC Name2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccccc1NS(=O)(=O)c1ccccc1N
InChIInChI=1S/C14H15N3O3S/c1-16-14(18)10-6-2-4-8-12(10)17-21(19,20)13-9-5-3-7-11(13)15/h2-9,17H,15H2,1H3,(H,16,18)
InChIKeyYSYBBJLEPWEDJZ-UHFFFAOYSA-N
XLogP1.43
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 51.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[(2-aminophenyl)sulfonylamino]benzamide
CID 43576271
2-[(2-chloro-3-pyridinyl)sulfonylamino]-N-methylbenzamide
CID 60721981
2-[(5-bromo-2-methylphenyl)sulfonylamino]-N-methylbenzamide
CID 24502280
2-amino-N-(2-methylsulfonylphenyl)benzenesulfonamide
CID 61108416
2-amino-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 43402957
2-[(5-bromothiophen-2-yl)sulfonylamino]-N-methylbenzamide
CID 26268701
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-methylbenzamide
CID 26268702
2-amino-N-(2-iodophenyl)benzenesulfonamide
CID 43124657
1-(2-aminophenyl)sulfonyl-3-methylurea
CID 116645969
2-amino-N-(2-aminophenyl)sulfonylbenzamide
CID 166788214
2-(1-cyanoethylsulfonylamino)-N-methylbenzamide
CID 75438949
CID 91495824
CID 91495824

Frequently Asked Questions

What is the IUPAC name of 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide?
The IUPAC name of 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide (CID 43576281) is 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide.
What is the SMILES notation for 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide?
The canonical SMILES for 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide is CNC(=O)c1ccccc1NS(=O)(=O)c1ccccc1N.
What is the InChIKey of 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide?
The InChIKey is YSYBBJLEPWEDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-16-14(18)10-6-2-4-8-12(10)17-21(19,20)13-9-5-3-7-11(13)15/h2-9,17H,15H2,1H3,(H,16,18).
What are the key properties of 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide?
2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide has a molecular weight of 305.36 g/mol, XLogP of 1.43, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-aminophenyl)sulfonylamino]-N-methylbenzamide is sourced from PubChem (CID 43576281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).