4-(methanesulfonamido)benzamide

C8H10N2O3S — CID 961874

IUPAC4-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C8H10N2O3S/c1-14(12,13)10-7-4-2-6(3-5-7)8(9)11/h2-5,10H,1H3,(H2,9,11)
InChIKeyDVCWUTSWCVQZSC-UHFFFAOYSA-N
MW214.25 g/mol
LogP0.16
Rot. Bonds3

About 4-(methanesulfonamido)benzamide

4-(methanesulfonamido)benzamide (PubChem CID 961874) has the molecular formula C8H10N2O3S and a molecular weight of 214.25 g/mol. Its IUPAC name is 4-(methanesulfonamido)benzamide.

Molecular Properties

Compound Name4-(methanesulfonamido)benzamide
PubChem CID961874
Molecular FormulaC8H10N2O3S
Molecular Weight214.25 g/mol
Exact Mass214.04
IUPAC Name4-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C8H10N2O3S/c1-14(12,13)10-7-4-2-6(3-5-7)8(9)11/h2-5,10H,1H3,(H2,9,11)
InChIKeyDVCWUTSWCVQZSC-UHFFFAOYSA-N
XLogP0.16
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.25
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 563797
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CID 93163
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Frequently Asked Questions

What is the IUPAC name of 4-(methanesulfonamido)benzamide?
The IUPAC name of 4-(methanesulfonamido)benzamide (CID 961874) is 4-(methanesulfonamido)benzamide.
What is the SMILES notation for 4-(methanesulfonamido)benzamide?
The canonical SMILES for 4-(methanesulfonamido)benzamide is CS(=O)(=O)Nc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-(methanesulfonamido)benzamide?
The InChIKey is DVCWUTSWCVQZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3S/c1-14(12,13)10-7-4-2-6(3-5-7)8(9)11/h2-5,10H,1H3,(H2,9,11).
What are the key properties of 4-(methanesulfonamido)benzamide?
4-(methanesulfonamido)benzamide has a molecular weight of 214.25 g/mol, XLogP of 0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methanesulfonamido)benzamide is sourced from PubChem (CID 961874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).