N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide

C20H24N2O4S — CID 113095178

IUPACN-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(N(C2CC2)S(=O)(=O)c2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C20H24N2O4S/c1-14(2)26-19-10-12-20(13-11-19)27(24,25)22(18-8-9-18)17-6-4-16(5-7-17)21-15(3)23/h4-7,10-14,18H,8-9H2,1-3H3,(H,21,23)
InChIKeyTZFPOINWNFEVAN-UHFFFAOYSA-N
MW388.49 g/mol
LogP3.79
Rot. Bonds7

About N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide

N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide (PubChem CID 113095178) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide
PubChem CID113095178
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC NameN-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(N(C2CC2)S(=O)(=O)c2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C20H24N2O4S/c1-14(2)26-19-10-12-20(13-11-19)27(24,25)22(18-8-9-18)17-6-4-16(5-7-17)21-15(3)23/h4-7,10-14,18H,8-9H2,1-3H3,(H,21,23)
InChIKeyTZFPOINWNFEVAN-UHFFFAOYSA-N
XLogP3.79
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(4-methylphenyl)sulfonyl-(oxan-4-yl)amino]phenyl]acetamide
CID 113095248
N-[4-[(4-propan-2-yloxyphenyl)-prop-2-enylsulfamoyl]phenyl]acetamide
CID 100501553
N-[4-[cyclopropyl-(4-fluoro-3-methylphenyl)sulfonylamino]phenyl]acetamide
CID 113095149
N-[4-[(4-propan-2-yloxyphenyl)methylsulfamoyl]phenyl]acetamide
CID 53281637
N-[4-[cyclopropyl-(4-methoxy-2,5-dimethylphenyl)sulfonylamino]phenyl]acetamide
CID 113095161
N-[4-[(4-cyclopentyloxyphenyl)-ethylsulfamoyl]phenyl]acetamide
CID 100501820
N-cyclopropyl-N-[4-(methanesulfonamido)phenyl]-4-methylbenzenesulfonamide
CID 113094754
N-[4-[methylsulfonyl(oxan-4-yl)amino]phenyl]acetamide
CID 113094432
N-cyclopropyl-4-fluoro-N-[4-(methanesulfonamido)phenyl]benzenesulfonamide
CID 113094755
3-[acetyl(cyclohexyl)amino]-N-(4-propan-2-yloxyphenyl)propanamide
CID 113116640
methyl N-(4-acetamidophenyl)-N-cyclopropylcarbamate
CID 113095123
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(4-propan-2-yloxyphenyl)acetamide
CID 94079433

Frequently Asked Questions

What is the IUPAC name of N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide?
The IUPAC name of N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide (CID 113095178) is N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide is CC(=O)Nc1ccc(N(C2CC2)S(=O)(=O)c2ccc(OC(C)C)cc2)cc1.
What is the InChIKey of N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide?
The InChIKey is TZFPOINWNFEVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-14(2)26-19-10-12-20(13-11-19)27(24,25)22(18-8-9-18)17-6-4-16(5-7-17)21-15(3)23/h4-7,10-14,18H,8-9H2,1-3H3,(H,21,23).
What are the key properties of N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide?
N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide has a molecular weight of 388.49 g/mol, XLogP of 3.79, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[cyclopropyl-(4-propan-2-yloxyphenyl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 113095178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).