4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide

C18H23N3O5S — CID 130406385

IUPAC4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide
SMILESCCNc1cc(O)c(C(N)=O)cc1S(=O)(=O)Nc1ccc(OC(C)C)cc1
InChIInChI=1S/C18H23N3O5S/c1-4-20-15-10-16(22)14(18(19)23)9-17(15)27(24,25)21-12-5-7-13(8-6-12)26-11(2)3/h5-11,20-22H,4H2,1-3H3,(H2,19,23)
InChIKeyMOEOVVGTGZSHHQ-UHFFFAOYSA-N
MW393.47 g/mol
LogP2.51
Rot. Bonds8

About 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide

4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide (PubChem CID 130406385) has the molecular formula C18H23N3O5S and a molecular weight of 393.47 g/mol. Its IUPAC name is 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound Name4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide
PubChem CID130406385
Molecular FormulaC18H23N3O5S
Molecular Weight393.47 g/mol
Exact Mass393.14
IUPAC Name4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide
SMILESCCNc1cc(O)c(C(N)=O)cc1S(=O)(=O)Nc1ccc(OC(C)C)cc1
InChIInChI=1S/C18H23N3O5S/c1-4-20-15-10-16(22)14(18(19)23)9-17(15)27(24,25)21-12-5-7-13(8-6-12)26-11(2)3/h5-11,20-22H,4H2,1-3H3,(H2,19,23)
InChIKeyMOEOVVGTGZSHHQ-UHFFFAOYSA-N
XLogP2.51
TPSA130.75 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.47
LogP ≤ 52.51
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

2-hydroxy-4-(2-hydroxyethylamino)-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide
CID 130406270
4-[(2-amino-2-methanimidoyliminoethyl)amino]-2-hydroxy-5-(4-propan-2-yloxyanilino)sulfanylbenzamide
CID 130420875
2,4-difluoro-5-[[2-[(4-propan-2-yloxyphenyl)sulfamoyl]acetyl]amino]benzamide
CID 56573264
N-[4-(butylamino)phenyl]-4-propan-2-yloxybenzenesulfonamide
CID 112980319
2-methyl-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzoic acid
CID 51113766
N-[4-(3-methylbutylamino)phenyl]-4-propan-2-yloxybenzenesulfonamide
CID 112985174
N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
CID 5002728
5-methyl-N-(4-propan-2-yloxyphenyl)thiophene-2-sulfonamide
CID 47310549
N-[4-(diethylamino)phenyl]-4-propan-2-yloxybenzenesulfonamide
CID 112984727
3-methyl-5-[(4-propan-2-yloxyphenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 51115560
2-(4-propan-2-yloxyanilino)acetic acid
CID 28969819
ethyl N-(4-propan-2-yloxyphenyl)carbamate
CID 731078

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide?
The IUPAC name of 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide (CID 130406385) is 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide.
What is the SMILES notation for 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide?
The canonical SMILES for 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide is CCNc1cc(O)c(C(N)=O)cc1S(=O)(=O)Nc1ccc(OC(C)C)cc1.
What is the InChIKey of 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide?
The InChIKey is MOEOVVGTGZSHHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O5S/c1-4-20-15-10-16(22)14(18(19)23)9-17(15)27(24,25)21-12-5-7-13(8-6-12)26-11(2)3/h5-11,20-22H,4H2,1-3H3,(H2,19,23).
What are the key properties of 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide?
4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide has a molecular weight of 393.47 g/mol, XLogP of 2.51, 8 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-2-hydroxy-5-[(4-propan-2-yloxyphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 130406385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).