N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide

C133H208N18O24S6 — CID 158802984

IUPACN-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide
SMILESCC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(NC(=O)C3CCCCC3)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)CC1.CCC(C)NC(=O)c1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1.Cc1cc(C(=O)NC(C)C)c(C)c(C)c1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1.Cc1cc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c(C)c(C(=O)NC(C)C)c1
InChIInChI=1S/2C23H35N3O4S.C23H37N3O4S.C22H35N3O4S.2C21H33N3O4S/c1-16(2)31(29,30)26-19-13-11-18(12-14-19)23(28)25-21-10-6-9-20(15-21)24-22(27)17-7-4-3-5-8-17;1-16(2)31(29,30)26-21-10-8-18(9-11-21)23(28)25-20-14-12-19(13-15-20)24-22(27)17-6-4-3-5-7-17;1-13(2)24-23(28)20-12-15(5)21(17(7)16(20)6)25-22(27)18-8-10-19(11-9-18)26-31(29,30)14(3)4;1-13(2)23-22(27)19-11-15(5)12-20(16(19)6)24-21(26)17-7-9-18(10-8-17)25-30(28,29)14(3)4;1-14(2)29(27,28)24-18-12-8-15(9-13-18)19(25)22-17-10-6-16(7-11-17)20(26)23-21(3,4)5;1-5-15(4)22-20(25)16-6-10-18(11-7-16)23-21(26)17-8-12-19(13-9-17)24-29(27,28)14(2)3/h6,9-10,15-19,26H,3-5,7-8,11-14H2,1-2H3,(H,24,27)(H,25,28);12-18,21,26H,3-11H2,1-2H3,(H,24,27)(H,25,28);12-14,18-19,26H,8-11H2,1-7H3,(H,24,28)(H,25,27);11-14,17-18,25H,7-10H2,1-6H3,(H,23,27)(H,24,26);6-7,10-11,14-15,18,24H,8-9,12-13H2,1-5H3,(H,22,25)(H,23,26);6-7,10-11,14-15,17,19,24H,5,8-9,12-13H2,1-4H3,(H,22,25)(H,23,26)
InChIKeyITSLBEISNSGZFO-UHFFFAOYSA-N
MW2635.63 g/mol
LogP20.98
Rot. Bonds42

About N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide

N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide (PubChem CID 158802984) has the molecular formula C133H208N18O24S6 and a molecular weight of 2635.63 g/mol. Its IUPAC name is N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide.

Molecular Properties

Compound NameN-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide
PubChem CID158802984
Molecular FormulaC133H208N18O24S6
Molecular Weight2635.63 g/mol
Exact Mass2633.39
IUPAC NameN-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide
SMILESCC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(NC(=O)C3CCCCC3)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)CC1.CCC(C)NC(=O)c1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1.Cc1cc(C(=O)NC(C)C)c(C)c(C)c1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1.Cc1cc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c(C)c(C(=O)NC(C)C)c1
InChIInChI=1S/2C23H35N3O4S.C23H37N3O4S.C22H35N3O4S.2C21H33N3O4S/c1-16(2)31(29,30)26-19-13-11-18(12-14-19)23(28)25-21-10-6-9-20(15-21)24-22(27)17-7-4-3-5-8-17;1-16(2)31(29,30)26-21-10-8-18(9-11-21)23(28)25-20-14-12-19(13-15-20)24-22(27)17-6-4-3-5-7-17;1-13(2)24-23(28)20-12-15(5)21(17(7)16(20)6)25-22(27)18-8-10-19(11-9-18)26-31(29,30)14(3)4;1-13(2)23-22(27)19-11-15(5)12-20(16(19)6)24-21(26)17-7-9-18(10-8-17)25-30(28,29)14(3)4;1-14(2)29(27,28)24-18-12-8-15(9-13-18)19(25)22-17-10-6-16(7-11-17)20(26)23-21(3,4)5;1-5-15(4)22-20(25)16-6-10-18(11-7-16)23-21(26)17-8-12-19(13-9-17)24-29(27,28)14(2)3/h6,9-10,15-19,26H,3-5,7-8,11-14H2,1-2H3,(H,24,27)(H,25,28);12-18,21,26H,3-11H2,1-2H3,(H,24,27)(H,25,28);12-14,18-19,26H,8-11H2,1-7H3,(H,24,28)(H,25,27);11-14,17-18,25H,7-10H2,1-6H3,(H,23,27)(H,24,26);6-7,10-11,14-15,18,24H,8-9,12-13H2,1-5H3,(H,22,25)(H,23,26);6-7,10-11,14-15,17,19,24H,5,8-9,12-13H2,1-4H3,(H,22,25)(H,23,26)
InChIKeyITSLBEISNSGZFO-UHFFFAOYSA-N
XLogP20.98
TPSA626.22 Ų
H-Bond Donors18
H-Bond Acceptors24
Rotatable Bonds42
Heavy Atoms181
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002635.63
LogP ≤ 520.98
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1024

Analyze N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide?
The IUPAC name of N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide (CID 158802984) is N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide.
What is the SMILES notation for N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide?
The canonical SMILES for N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide is CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2ccc(NC(=O)C3CCCCC3)cc2)CC1.CC(C)S(=O)(=O)NC1CCC(C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)CC1.CCC(C)NC(=O)c1ccc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)cc1.Cc1cc(C(=O)NC(C)C)c(C)c(C)c1NC(=O)C1CCC(NS(=O)(=O)C(C)C)CC1.Cc1cc(NC(=O)C2CCC(NS(=O)(=O)C(C)C)CC2)c(C)c(C(=O)NC(C)C)c1.
What is the InChIKey of N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide?
The InChIKey is ITSLBEISNSGZFO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H35N3O4S.C23H37N3O4S.C22H35N3O4S.2C21H33N3O4S/c1-16(2)31(29,30)26-19-13-11-18(12-14-19)23(28)25-21-10-6-9-20(15-21)24-22(27)17-7-4-3-5-8-17;1-16(2)31(29,30)26-21-10-8-18(9-11-21)23(28)25-20-14-12-19(13-15-20)24-22(27)17-6-4-3-5-7-17;1-13(2)24-23(28)20-12-15(5)21(17(7)16(20)6)25-22(27)18-8-10-19(11-9-18)26-31(29,30)14(3)4;1-13(2)23-22(27)19-11-15(5)12-20(16(19)6)24-21(26)17-7-9-18(10-8-17)25-30(28,29)14(3)4;1-14(2)29(27,28)24-18-12-8-15(9-13-18)19(25)22-17-10-6-16(7-11-17)20(26)23-21(3,4)5;1-5-15(4)22-20(25)16-6-10-18(11-7-16)23-21(26)17-8-12-19(13-9-17)24-29(27,28)14(2)3/h6,9-10,15-19,26H,3-5,7-8,11-14H2,1-2H3,(H,24,27)(H,25,28);12-18,21,26H,3-11H2,1-2H3,(H,24,27)(H,25,28);12-14,18-19,26H,8-11H2,1-7H3,(H,24,28)(H,25,27);11-14,17-18,25H,7-10H2,1-6H3,(H,23,27)(H,24,26);6-7,10-11,14-15,18,24H,8-9,12-13H2,1-5H3,(H,22,25)(H,23,26);6-7,10-11,14-15,17,19,24H,5,8-9,12-13H2,1-4H3,(H,22,25)(H,23,26).
What are the key properties of N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide?
N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide has a molecular weight of 2635.63 g/mol, XLogP of 20.98, 42 rotatable bonds, 18 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-tert-butyl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;N-[3-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;N-[4-(cyclohexanecarbonylamino)phenyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide;2,5-dimethyl-N-propan-2-yl-3-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide;2,3,5-trimethyl-N-propan-2-yl-4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]benzamide is sourced from PubChem (CID 158802984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).