2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide

C12H16N2O3S — CID 892330

IUPAC2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C12H16N2O3S/c1-14(9-12(15)13-10-7-8-10)18(16,17)11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,13,15)
InChIKeyRVNFZOUQAVCWKI-UHFFFAOYSA-N
MW268.34 g/mol
LogP0.59
Rot. Bonds5

About 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide

2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide (PubChem CID 892330) has the molecular formula C12H16N2O3S and a molecular weight of 268.34 g/mol. Its IUPAC name is 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide
PubChem CID892330
Molecular FormulaC12H16N2O3S
Molecular Weight268.34 g/mol
Exact Mass268.09
IUPAC Name2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C12H16N2O3S/c1-14(9-12(15)13-10-7-8-10)18(16,17)11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,13,15)
InChIKeyRVNFZOUQAVCWKI-UHFFFAOYSA-N
XLogP0.59
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 2957593
2-[benzene(2-methylpropyl)sulfonamido]-N-hydroxyacetamide
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N-(2-Oxo-2-pyrrolidin-1-yl-ethyl)-benzenesulfonamide
CID 891761
N~1~-cyclopropyl-N~2~-[(4-methylphenyl)sulfonyl]glycinamide
CID 894343
N-cyclopropyl-N~2~-[(4-fluorophenyl)sulfonyl]-N~2~-methylglycinamide
CID 975127
2-[benzenesulfonyl(ethyl)amino]-N-[2-(cyclohexen-1-yl)ethyl]acetamide
CID 2229748
1-[N-(phenylsulfonyl)glycylglycyl]piperidine
CID 2233338
N-cyclopropyl-2-[2-(4-sulfamoylphenyl)ethylamino]acetamide
CID 2560197
N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
CID 2985558
(2S)-2-[(4-fluorophenyl)sulfonylamino]-3-methyl-N-[(2S)-1-oxopropan-2-yl]butanamide
CID 11782479
N-(2-oxoazepan-3-yl)benzenesulfonamide
CID 2813201
N-ethyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
CID 2985919

Frequently Asked Questions

What is the IUPAC name of 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide?
The IUPAC name of 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide (CID 892330) is 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide is CN(CC(=O)NC1CC1)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide?
The InChIKey is RVNFZOUQAVCWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3S/c1-14(9-12(15)13-10-7-8-10)18(16,17)11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,13,15).
What are the key properties of 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide?
2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide has a molecular weight of 268.34 g/mol, XLogP of 0.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzenesulfonyl(methyl)amino]-N-cyclopropylacetamide is sourced from PubChem (CID 892330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).