N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide

C90H106ClF3N10O17S5 — CID 157241285

IUPACN-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide
SMILESCC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(C(C)(C)C)cc2)cc1.CC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1.CC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1.CCC(C)c1ccc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)cc1.COc1ccc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)cc1
InChIInChI=1S/2C20H26N2O3S.C17H17F3N2O4S.C17H20N2O4S.C16H17ClN2O3S/c1-14(2)26(24,25)22-18-10-6-15(7-11-18)19(23)21-17-12-8-16(9-13-17)20(3,4)5;1-5-15(4)16-6-10-18(11-7-16)21-20(23)17-8-12-19(13-9-17)22-26(24,25)14(2)3;1-11(2)27(24,25)22-14-5-3-12(4-6-14)16(23)21-13-7-9-15(10-8-13)26-17(18,19)20;1-12(2)24(21,22)19-15-6-4-13(5-7-15)17(20)18-14-8-10-16(23-3)11-9-14;1-11(2)23(21,22)19-15-7-3-12(4-8-15)16(20)18-14-9-5-13(17)6-10-14/h6-14,22H,1-5H3,(H,21,23);6-15,22H,5H2,1-4H3,(H,21,23);3-11,22H,1-2H3,(H,21,23);4-12,19H,1-3H3,(H,18,20);3-11,19H,1-2H3,(H,18,20)
InChIKeyAVFZUVCWVPUKLG-UHFFFAOYSA-N
MW1852.67 g/mol
LogP19.82
Rot. Bonds29

About N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide

N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide (PubChem CID 157241285) has the molecular formula C90H106ClF3N10O17S5 and a molecular weight of 1852.67 g/mol. Its IUPAC name is N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide.

Molecular Properties

Compound NameN-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide
PubChem CID157241285
Molecular FormulaC90H106ClF3N10O17S5
Molecular Weight1852.67 g/mol
Exact Mass1850.60
IUPAC NameN-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide
SMILESCC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(C(C)(C)C)cc2)cc1.CC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1.CC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1.CCC(C)c1ccc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)cc1.COc1ccc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)cc1
InChIInChI=1S/2C20H26N2O3S.C17H17F3N2O4S.C17H20N2O4S.C16H17ClN2O3S/c1-14(2)26(24,25)22-18-10-6-15(7-11-18)19(23)21-17-12-8-16(9-13-17)20(3,4)5;1-5-15(4)16-6-10-18(11-7-16)21-20(23)17-8-12-19(13-9-17)22-26(24,25)14(2)3;1-11(2)27(24,25)22-14-5-3-12(4-6-14)16(23)21-13-7-9-15(10-8-13)26-17(18,19)20;1-12(2)24(21,22)19-15-6-4-13(5-7-15)17(20)18-14-8-10-16(23-3)11-9-14;1-11(2)23(21,22)19-15-7-3-12(4-8-15)16(20)18-14-9-5-13(17)6-10-14/h6-14,22H,1-5H3,(H,21,23);6-15,22H,5H2,1-4H3,(H,21,23);3-11,22H,1-2H3,(H,21,23);4-12,19H,1-3H3,(H,18,20);3-11,19H,1-2H3,(H,18,20)
InChIKeyAVFZUVCWVPUKLG-UHFFFAOYSA-N
XLogP19.82
TPSA394.81 Ų
H-Bond Donors10
H-Bond Acceptors17
Rotatable Bonds29
Heavy Atoms126
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001852.67
LogP ≤ 519.82
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1017

Analyze N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[bis[(4-chloro-2-fluorophenyl)sulfonyl]amino]-N-(4-methoxyphenyl)benzamide
CID 16331496
4-[(4-Butan-2-ylanilino)methyl]aniline;4-[(4-tert-butylanilino)methyl]aniline;4-[(4-chloroanilino)methyl]aniline;4-[(4-methoxyanilino)methyl]aniline;hexakis(2-methylpropane-2-sulfinate);4-[(4-propan-2-ylanilino)methyl]aniline;4-[[4-(trifluoromethoxy)anilino]methyl]aniline
CID 157320943
N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-propan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide;4-(propan-2-ylsulfonylamino)-N-(2,4,6-trifluorophenyl)benzamide
CID 157483960
N-(4-butan-2-ylphenyl)-4-(tert-butylsulfonylamino)cyclohexane-1-carboxamide;N-(4-tert-butylphenyl)-4-(tert-butylsulfonylamino)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-chlorophenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(2-fluorophenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(3-fluorophenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(4-propan-2-ylphenyl)cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]cyclohexane-1-carboxamide;4-(tert-butylsulfonylamino)-N-(2,4,6-trifluorophenyl)cyclohexane-1-carboxamide
CID 157588650
N-(4-butan-2-ylphenyl)-4-(tert-butylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-(4-chlorophenyl)benzamide;4-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 158232012
N-(4-butan-2-ylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-tert-butylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-chlorophenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-ethylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-methoxyphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-methylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-phenyl-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-propan-2-ylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;5-(propan-2-ylsulfonylamino)-N-(4-propylphenyl)pentanamide;5-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide
CID 158873175
CID 159423913
CID 159423913
N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-methylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(2-fluorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(3-fluorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-propan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(4-propylphenyl)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide;4-(propan-2-ylsulfonylamino)-N-(2,4,6-trifluorophenyl)benzamide
CID 159547044
N-(4-butan-2-ylphenyl)-4-(tert-butylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(tert-butylsulfonylamino)benzamide;4-(tert-butylsulfonylamino)-N-(4-chlorophenyl)benzamide;4-(tert-butylsulfonylamino)-N-(4-methoxyphenyl)benzamide;4-(tert-butylsulfonylamino)-N-(4-propan-2-ylphenyl)benzamide;4-(tert-butylsulfonylamino)-N-(4-propylphenyl)benzamide;4-(tert-butylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 159621475
N-(4-butan-2-ylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-tert-butylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-chlorophenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-ethylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-methoxyphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;N-(4-propan-2-ylphenyl)-5-(propan-2-ylsulfonylamino)pentanamide;5-(propan-2-ylsulfonylamino)-N-(4-propylphenyl)pentanamide;5-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]pentanamide
CID 159648859
N-[(4-aminophenyl)methyl]-2-fluoroaniline;N-[(4-aminophenyl)methyl]-3-fluoroaniline;N-[(4-aminophenyl)methyl]-2,4,6-trifluoroaniline;4-[(4-tert-butylanilino)methyl]aniline;4-[(4-chloroanilino)methyl]aniline;N-[4-[(4-methoxyanilino)methyl]phenyl]propane-2-sulfonamide;hexakis(propane-2-sulfinate);4-[[4-(trifluoromethoxy)anilino]methyl]aniline
CID 159818953
N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-ethylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2-fluorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-propan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(4-propylphenyl)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide;4-(propan-2-ylsulfonylamino)-N-(2,4,6-trifluorophenyl)benzamide
CID 159947807

Frequently Asked Questions

What is the IUPAC name of N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide?
The IUPAC name of N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide (CID 157241285) is N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide.
What is the SMILES notation for N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide?
The canonical SMILES for N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide is CC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(C(C)(C)C)cc2)cc1.CC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1.CC(C)S(=O)(=O)Nc1ccc(C(=O)Nc2ccc(OC(F)(F)F)cc2)cc1.CCC(C)c1ccc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)cc1.COc1ccc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)cc1.
What is the InChIKey of N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide?
The InChIKey is AVFZUVCWVPUKLG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H26N2O3S.C17H17F3N2O4S.C17H20N2O4S.C16H17ClN2O3S/c1-14(2)26(24,25)22-18-10-6-15(7-11-18)19(23)21-17-12-8-16(9-13-17)20(3,4)5;1-5-15(4)16-6-10-18(11-7-16)21-20(23)17-8-12-19(13-9-17)22-26(24,25)14(2)3;1-11(2)27(24,25)22-14-5-3-12(4-6-14)16(23)21-13-7-9-15(10-8-13)26-17(18,19)20;1-12(2)24(21,22)19-15-6-4-13(5-7-15)17(20)18-14-8-10-16(23-3)11-9-14;1-11(2)23(21,22)19-15-7-3-12(4-8-15)16(20)18-14-9-5-13(17)6-10-14/h6-14,22H,1-5H3,(H,21,23);6-15,22H,5H2,1-4H3,(H,21,23);3-11,22H,1-2H3,(H,21,23);4-12,19H,1-3H3,(H,18,20);3-11,19H,1-2H3,(H,18,20).
What are the key properties of N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide?
N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide has a molecular weight of 1852.67 g/mol, XLogP of 19.82, 29 rotatable bonds, 10 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butan-2-ylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-tert-butylphenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-chlorophenyl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4-methoxyphenyl)-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-[4-(trifluoromethoxy)phenyl]benzamide is sourced from PubChem (CID 157241285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).