N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide

C19H22N2O3S — CID 46532975

IUPACN-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide
SMILESCC(C)(C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1
InChIInChI=1S/C19H22N2O3S/c1-19(2,14-7-4-3-5-8-14)18(22)20-16-9-6-10-17(13-16)25(23,24)21-15-11-12-15/h3-10,13,15,21H,11-12H2,1-2H3,(H,20,22)
InChIKeyBPZRUCFVJIPLAE-UHFFFAOYSA-N
MW358.46 g/mol
LogP3.04
Rot. Bonds6

About N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide

N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide (PubChem CID 46532975) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide
PubChem CID46532975
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC NameN-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide
SMILESCC(C)(C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1
InChIInChI=1S/C19H22N2O3S/c1-19(2,14-7-4-3-5-8-14)18(22)20-16-9-6-10-17(13-16)25(23,24)21-15-11-12-15/h3-10,13,15,21H,11-12H2,1-2H3,(H,20,22)
InChIKeyBPZRUCFVJIPLAE-UHFFFAOYSA-N
XLogP3.04
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide?
The IUPAC name of N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide (CID 46532975) is N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide.
What is the SMILES notation for N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide?
The canonical SMILES for N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide is CC(C)(C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1.
What is the InChIKey of N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide?
The InChIKey is BPZRUCFVJIPLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-19(2,14-7-4-3-5-8-14)18(22)20-16-9-6-10-17(13-16)25(23,24)21-15-11-12-15/h3-10,13,15,21H,11-12H2,1-2H3,(H,20,22).
What are the key properties of N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide?
N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide has a molecular weight of 358.46 g/mol, XLogP of 3.04, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide is sourced from PubChem (CID 46532975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).