N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide

C18H22N2O4S — CID 172906766

IUPACN-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide
SMILESCCCOc1cc(C)ccc1S(=O)(=O)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C18H22N2O4S/c1-4-11-24-17-12-13(2)5-10-18(17)25(22,23)20-16-8-6-15(7-9-16)19-14(3)21/h5-10,12,20H,4,11H2,1-3H3,(H,19,21)
InChIKeyHWWSGQKMTIIUOH-UHFFFAOYSA-N
MW362.45 g/mol
LogP3.54
Rot. Bonds7

About N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide

N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide (PubChem CID 172906766) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide
PubChem CID172906766
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC NameN-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide
SMILESCCCOc1cc(C)ccc1S(=O)(=O)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C18H22N2O4S/c1-4-11-24-17-12-13(2)5-10-18(17)25(22,23)20-16-8-6-15(7-9-16)19-14(3)21/h5-10,12,20H,4,11H2,1-3H3,(H,19,21)
InChIKeyHWWSGQKMTIIUOH-UHFFFAOYSA-N
XLogP3.54
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethylphenyl)-4-methyl-2-pentoxybenzenesulfonamide
CID 16645088
4-methyl-N-(4-methyl-2-pyridinyl)-2-propoxybenzenesulfonamide
CID 47001879
ethyl N-[4-[(2,4-dimethylphenyl)sulfonylamino]phenyl]carbamate
CID 60534888
N-[4-[(2,4-dimethoxyphenyl)sulfonylamino]phenyl]acetamide
CID 22774828
N-(4-methyl-2-propoxyphenyl)methanesulfonamide
CID 61063067
N-(4-iodophenyl)-2-methoxy-4-methylbenzenesulfonamide
CID 50876651
1,3-bis[4-[(2,5-dimethylphenyl)sulfonylamino]phenyl]urea
CID 170548873
4-methyl-N-(2-methylphenyl)-2-pentoxybenzenesulfonamide
CID 16645091
N-(4-methyl-2-propoxyphenyl)propane-1-sulfonamide
CID 61063068
2-ethoxy-4-methyl-N-pyridin-3-ylbenzenesulfonamide
CID 15943881
N-[4-[[4-(propylsulfamoyl)phenyl]sulfamoyl]phenyl]acetamide
CID 2134216
[1-(4-acetylanilino)-1-oxopropan-2-yl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate
CID 3549447

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide?
The IUPAC name of N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide (CID 172906766) is N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide is CCCOc1cc(C)ccc1S(=O)(=O)Nc1ccc(NC(C)=O)cc1.
What is the InChIKey of N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide?
The InChIKey is HWWSGQKMTIIUOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-4-11-24-17-12-13(2)5-10-18(17)25(22,23)20-16-8-6-15(7-9-16)19-14(3)21/h5-10,12,20H,4,11H2,1-3H3,(H,19,21).
What are the key properties of N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide?
N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide has a molecular weight of 362.45 g/mol, XLogP of 3.54, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-methyl-2-propoxyphenyl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 172906766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).