N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide

C19H24N2O4S — CID 92681993

IUPACN-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide
SMILESCOc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)CCc1ccccc1
InChIInChI=1S/C19H24N2O4S/c1-14(2)21-26(23,24)16-10-11-18(25-3)17(13-16)20-19(22)12-9-15-7-5-4-6-8-15/h4-8,10-11,13-14,21H,9,12H2,1-3H3,(H,20,22)
InChIKeyAQKONWJZWOUPEZ-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.95
Rot. Bonds8

About N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide

N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide (PubChem CID 92681993) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide
PubChem CID92681993
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide
SMILESCOc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)CCc1ccccc1
InChIInChI=1S/C19H24N2O4S/c1-14(2)21-26(23,24)16-10-11-18(25-3)17(13-16)20-19(22)12-9-15-7-5-4-6-8-15/h4-8,10-11,13-14,21H,9,12H2,1-3H3,(H,20,22)
InChIKeyAQKONWJZWOUPEZ-UHFFFAOYSA-N
XLogP2.95
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,6-dichlorophenyl)-N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 100602358
N-(2-methoxy-5-pentan-3-ylsulfonylphenyl)-3-phenylpropanamide
CID 3270673
N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-2-(2-phenylethyl)benzamide
CID 46764322
2-(2-chlorophenyl)-N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 100632426
N-(5-chloro-2-phenoxyphenyl)-3-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 1006992
2-benzylsulfanyl-N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 30385415
2-(N-(4-fluorophenyl)sulfonylanilino)-N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 43876537
2-[N-(benzenesulfonyl)-4-methoxyanilino]-N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 43901959
2-(2-methoxy-N-methylsulfonylanilino)-N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 92684341
N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-2-(2-nitrophenyl)acetamide
CID 92673619
2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 43901876
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide
CID 7733250

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide?
The IUPAC name of N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide (CID 92681993) is N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide.
What is the SMILES notation for N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide?
The canonical SMILES for N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide is COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)CCc1ccccc1.
What is the InChIKey of N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide?
The InChIKey is AQKONWJZWOUPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-14(2)21-26(23,24)16-10-11-18(25-3)17(13-16)20-19(22)12-9-15-7-5-4-6-8-15/h4-8,10-11,13-14,21H,9,12H2,1-3H3,(H,20,22).
What are the key properties of N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide?
N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide has a molecular weight of 376.48 g/mol, XLogP of 2.95, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-5-(propan-2-ylsulfamoyl)phenyl]-3-phenylpropanamide is sourced from PubChem (CID 92681993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).