N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide

C19H23FN2O4S — CID 113060991

IUPACN-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1N(CCNS(=O)(=O)c1ccc(F)c(C)c1)C(C)=O
InChIInChI=1S/C19H23FN2O4S/c1-13-5-8-19(26-4)18(11-13)22(15(3)23)10-9-21-27(24,25)16-6-7-17(20)14(2)12-16/h5-8,11-12,21H,9-10H2,1-4H3
InChIKeyFMCWTRKHUTWSAR-UHFFFAOYSA-N
MW394.47 g/mol
LogP2.78
Rot. Bonds7

About N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide

N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 113060991) has the molecular formula C19H23FN2O4S and a molecular weight of 394.47 g/mol. Its IUPAC name is N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID113060991
Molecular FormulaC19H23FN2O4S
Molecular Weight394.47 g/mol
Exact Mass394.14
IUPAC NameN-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1N(CCNS(=O)(=O)c1ccc(F)c(C)c1)C(C)=O
InChIInChI=1S/C19H23FN2O4S/c1-13-5-8-19(26-4)18(11-13)22(15(3)23)10-9-21-27(24,25)16-6-7-17(20)14(2)12-16/h5-8,11-12,21H,9-10H2,1-4H3
InChIKeyFMCWTRKHUTWSAR-UHFFFAOYSA-N
XLogP2.78
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.47
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethylphenyl)-N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113058367
N-(3,4-dimethylphenyl)-N-[2-[(4-methoxy-3-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113057949
N-(2,4-dimethoxyphenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113061279
N-(3,4-dimethoxyphenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113061350
N-(2,6-difluorophenyl)-N-[2-[(3,4-dimethylphenyl)sulfonylamino]ethyl]acetamide
CID 113064567
N-(4-chloro-2-methylphenyl)-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]acetamide
CID 113059951
N-(2,6-difluorophenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113064563
N-(3,4-difluorophenyl)-N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]acetamide
CID 113064672
N-[2-[(3,4-dimethylphenyl)sulfonylamino]ethyl]-N-[(3-methylphenyl)methyl]acetamide
CID 113054288
N-[2-(N-acetyl-2-methoxy-5-methylanilino)ethyl]-4-(trifluoromethyl)benzamide
CID 113060962
N-(2,4-dimethylphenyl)-N-[2-[(2,4-dimethylphenyl)sulfonylamino]ethyl]acetamide
CID 113057732
3-(N-acetyl-2-methoxy-5-methylanilino)-N-(3-chloro-4-fluorophenyl)propanamide
CID 113129632

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide (CID 113060991) is N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide is COc1ccc(C)cc1N(CCNS(=O)(=O)c1ccc(F)c(C)c1)C(C)=O.
What is the InChIKey of N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is FMCWTRKHUTWSAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O4S/c1-13-5-8-19(26-4)18(11-13)22(15(3)23)10-9-21-27(24,25)16-6-7-17(20)14(2)12-16/h5-8,11-12,21H,9-10H2,1-4H3.
What are the key properties of N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide?
N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 394.47 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-fluoro-3-methylphenyl)sulfonylamino]ethyl]-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 113060991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).