2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide

C11H15ClN2O3S — CID 53278410

IUPAC2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide
SMILESCCNC(=O)c1cc(N(C)S(C)(=O)=O)ccc1Cl
InChIInChI=1S/C11H15ClN2O3S/c1-4-13-11(15)9-7-8(5-6-10(9)12)14(2)18(3,16)17/h5-7H,4H2,1-3H3,(H,13,15)
InChIKeyPNWJAZKPQJBTJB-UHFFFAOYSA-N
MW290.77 g/mol
LogP1.49
Rot. Bonds4

About 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide

2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide (PubChem CID 53278410) has the molecular formula C11H15ClN2O3S and a molecular weight of 290.77 g/mol. Its IUPAC name is 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide
PubChem CID53278410
Molecular FormulaC11H15ClN2O3S
Molecular Weight290.77 g/mol
Exact Mass290.05
IUPAC Name2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide
SMILESCCNC(=O)c1cc(N(C)S(C)(=O)=O)ccc1Cl
InChIInChI=1S/C11H15ClN2O3S/c1-4-13-11(15)9-7-8(5-6-10(9)12)14(2)18(3,16)17/h5-7H,4H2,1-3H3,(H,13,15)
InChIKeyPNWJAZKPQJBTJB-UHFFFAOYSA-N
XLogP1.49
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.77
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-cyclohexyl-5-[methyl(methylsulfonyl)amino]benzamide
CID 53278340
2-chloro-N-[(1S)-1-(2-methoxyphenyl)ethyl]-5-[methyl(methylsulfonyl)amino]benzamide
CID 100677066
2-chloro-4-[methyl(methylsulfonyl)amino]-N-(3-morpholin-4-ylpropyl)benzamide
CID 50945225
ethyl 2-chloro-5-[[4-[methyl(methylsulfonyl)amino]benzoyl]amino]benzoate
CID 46778786
2-chloro-N-[1-(4-ethylphenyl)ethyl]-4-[methyl(methylsulfonyl)amino]benzamide
CID 133199988
2-chloro-N-(2,6-dimethylphenyl)-4-[methyl(methylsulfonyl)amino]benzamide
CID 50944504
N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-chloro-5-[methyl(methylsulfonyl)amino]benzamide
CID 100711277
2-chloro-4-[methyl(methylsulfonyl)amino]-N-(2-methyl-1-phenylpropan-2-yl)benzamide
CID 100767114
4-[methyl(methylsulfonyl)amino]-N-propylbenzamide
CID 53279666
N-[(4-fluorophenyl)methyl]-2-methoxy-5-[methyl(methylsulfonyl)amino]benzamide
CID 28560777
2-chloro-4-[methyl(methylsulfonyl)amino]-N-[3-(3-methylpiperidin-1-yl)propyl]benzamide
CID 53278155
2-chloro-N-(2,2-diethyl-3,4-dihydrochromen-4-yl)-4-[methyl(methylsulfonyl)amino]benzamide
CID 133262150

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide?
The IUPAC name of 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide (CID 53278410) is 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide.
What is the SMILES notation for 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide?
The canonical SMILES for 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide is CCNC(=O)c1cc(N(C)S(C)(=O)=O)ccc1Cl.
What is the InChIKey of 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide?
The InChIKey is PNWJAZKPQJBTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O3S/c1-4-13-11(15)9-7-8(5-6-10(9)12)14(2)18(3,16)17/h5-7H,4H2,1-3H3,(H,13,15).
What are the key properties of 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide?
2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide has a molecular weight of 290.77 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-5-[methyl(methylsulfonyl)amino]benzamide is sourced from PubChem (CID 53278410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).