5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide

C20H24N2O4S — CID 18131994

IUPAC5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide
SMILESCOc1ccccc1C(C)NC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C
InChIInChI=1S/C20H24N2O4S/c1-13-8-11-16(27(24,25)22-15-9-10-15)12-18(13)20(23)21-14(2)17-6-4-5-7-19(17)26-3/h4-8,11-12,14-15,22H,9-10H2,1-3H3,(H,21,23)
InChIKeyPLEKSNCNDOFSEE-UHFFFAOYSA-N
MW388.49 g/mol
LogP2.94
Rot. Bonds7

About 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide

5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide (PubChem CID 18131994) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide.

Molecular Properties

Compound Name5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide
PubChem CID18131994
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC Name5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide
SMILESCOc1ccccc1C(C)NC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C
InChIInChI=1S/C20H24N2O4S/c1-13-8-11-16(27(24,25)22-15-9-10-15)12-18(13)20(23)21-14(2)17-6-4-5-7-19(17)26-3/h4-8,11-12,14-15,22H,9-10H2,1-3H3,(H,21,23)
InChIKeyPLEKSNCNDOFSEE-UHFFFAOYSA-N
XLogP2.94
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 51233854
N-[cyclopropyl(phenyl)methyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide
CID 42890157
N-[(1S)-1-(2-methoxyphenyl)ethyl]-2,5-dimethylbenzamide
CID 2473869
5-(cyclopropylsulfamoyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-2-methylbenzamide
CID 55993372
2-methyl-N-[1-(2-methylphenyl)ethyl]-5-(methylsulfamoyl)benzamide
CID 43037445
methyl 5-[[(1S)-1-(2-methoxyphenyl)ethyl]sulfamoyl]-2-methylbenzoate
CID 100763986
N-(1-amino-4-methylpentan-2-yl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide;hydrochloride
CID 119586889
5-(2-methoxyethylsulfamoyl)-2-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
CID 51164465
2-[[5-(cyclopropylsulfamoyl)-2-methylbenzoyl]amino]-4-methylpentanoic acid
CID 119187975
N-(3-amino-4-methoxyphenyl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide
CID 119419615
N-cyclopropyl-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-methylbenzenesulfonamide
CID 35131778
4-[[(3S)-1,1-dioxothiolan-3-yl]sulfamoyl]-N-[(1R)-1-(2-methoxyphenyl)ethyl]benzamide
CID 26003595

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide?
The IUPAC name of 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide (CID 18131994) is 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide.
What is the SMILES notation for 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide?
The canonical SMILES for 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide is COc1ccccc1C(C)NC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C.
What is the InChIKey of 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide?
The InChIKey is PLEKSNCNDOFSEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-13-8-11-16(27(24,25)22-15-9-10-15)12-18(13)20(23)21-14(2)17-6-4-5-7-19(17)26-3/h4-8,11-12,14-15,22H,9-10H2,1-3H3,(H,21,23).
What are the key properties of 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide?
5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide has a molecular weight of 388.49 g/mol, XLogP of 2.94, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide is sourced from PubChem (CID 18131994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).