N-[benzenesulfonyl(methyl)amino]formamide

C8H10N2O3S — CID 175411358

IUPACN-[benzenesulfonyl(methyl)amino]formamide
SMILESCN(NC=O)S(=O)(=O)c1ccccc1
InChIInChI=1S/C8H10N2O3S/c1-10(9-7-11)14(12,13)8-5-3-2-4-6-8/h2-7H,1H3,(H,9,11)
InChIKeyLGNBLNLMBSBQAU-UHFFFAOYSA-N
MW214.25 g/mol
LogP-0.03
Rot. Bonds4

About N-[benzenesulfonyl(methyl)amino]formamide

N-[benzenesulfonyl(methyl)amino]formamide (PubChem CID 175411358) has the molecular formula C8H10N2O3S and a molecular weight of 214.25 g/mol. Its IUPAC name is N-[benzenesulfonyl(methyl)amino]formamide.

Molecular Properties

Compound NameN-[benzenesulfonyl(methyl)amino]formamide
PubChem CID175411358
Molecular FormulaC8H10N2O3S
Molecular Weight214.25 g/mol
Exact Mass214.04
IUPAC NameN-[benzenesulfonyl(methyl)amino]formamide
SMILESCN(NC=O)S(=O)(=O)c1ccccc1
InChIInChI=1S/C8H10N2O3S/c1-10(9-7-11)14(12,13)8-5-3-2-4-6-8/h2-7H,1H3,(H,9,11)
InChIKeyLGNBLNLMBSBQAU-UHFFFAOYSA-N
XLogP-0.03
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.25
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[benzenesulfonyl(methyl)amino]urea
CID 172749121
N-[methyl-[(Z)-N-methylsulfonyl-C-phenylcarbonimidoyl]amino]formamide
CID 143634485
2-[benzenesulfonyl(methyl)amino]-2-methylpropanoic acid
CID 62818706
N-(bromomethyl)-N-methylbenzenesulfonamide
CID 66916911
N-methyl-N-(2,2,2-trifluoroethyl)benzenesulfonamide
CID 60762861
N,N-diphenylbenzenesulfonamide;N-methyl-N-phenylbenzenesulfonamide
CID 158565705
N-methyl-N-(1-phenylethyl)benzenesulfonamide
CID 23331017
3-[benzenesulfonyl-[2-[benzenesulfonyl(2-carboxyethyl)amino]ethyl]amino]propanoic acid
CID 21496766
N-(benzenesulfonyl)-N-nitroformamide
CID 54117272
N-(4-bromophenyl)-N-methylbenzenesulfonamide
CID 5171346
N-methyl-N-(2-methylsulfonylethyl)benzenesulfonamide
CID 78925058
N-methyl-N-(2-phenylphenyl)benzenesulfonamide
CID 95046460

Frequently Asked Questions

What is the IUPAC name of N-[benzenesulfonyl(methyl)amino]formamide?
The IUPAC name of N-[benzenesulfonyl(methyl)amino]formamide (CID 175411358) is N-[benzenesulfonyl(methyl)amino]formamide.
What is the SMILES notation for N-[benzenesulfonyl(methyl)amino]formamide?
The canonical SMILES for N-[benzenesulfonyl(methyl)amino]formamide is CN(NC=O)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-[benzenesulfonyl(methyl)amino]formamide?
The InChIKey is LGNBLNLMBSBQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3S/c1-10(9-7-11)14(12,13)8-5-3-2-4-6-8/h2-7H,1H3,(H,9,11).
What are the key properties of N-[benzenesulfonyl(methyl)amino]formamide?
N-[benzenesulfonyl(methyl)amino]formamide has a molecular weight of 214.25 g/mol, XLogP of -0.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[benzenesulfonyl(methyl)amino]formamide is sourced from PubChem (CID 175411358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).