N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide

C125H179F10N19O24S6 — CID 162008633

IUPACN-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide
SMILESCC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(F)c(OC(F)(F)F)c2)CC1.CC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc3c(c2)C(=O)N(c2ccc(C(F)(F)F)cc2)C3=O)CC1.CC1CC(C)CC(c2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)C1.CC1CC(Oc2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)CC(C)O1.CC1CCCC(c2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)C1C.COc1cc(NC(=O)N2CCC(NS(=O)(=O)C(C)C)CC2)ccc1C(F)(F)F
InChIInChI=1S/C24H25F3N4O5S.2C23H37N3O3S.C22H35N3O5S.C17H24F3N3O4S.C16H21F4N3O4S/c1-14(2)37(35,36)29-16-9-11-30(12-10-16)23(34)28-17-5-8-19-20(13-17)22(33)31(21(19)32)18-6-3-15(4-7-18)24(25,26)27;1-16(2)30(28,29)25-22-9-11-26(12-10-22)23(27)24-21-7-5-19(6-8-21)20-14-17(3)13-18(4)15-20;1-16(2)30(28,29)25-21-12-14-26(15-13-21)23(27)24-20-10-8-19(9-11-20)22-7-5-6-17(3)18(22)4;1-15(2)31(27,28)24-19-9-11-25(12-10-19)22(26)23-18-5-7-20(8-6-18)30-21-13-16(3)29-17(4)14-21;1-11(2)28(25,26)22-12-6-8-23(9-7-12)16(24)21-13-4-5-14(17(18,19)20)15(10-13)27-3;1-10(2)28(25,26)22-11-5-7-23(8-6-11)15(24)21-12-3-4-13(17)14(9-12)27-16(18,19)20/h3-8,13-14,16,29H,9-12H2,1-2H3,(H,28,34);5-8,16-18,20,22,25H,9-15H2,1-4H3,(H,24,27);8-11,16-18,21-22,25H,5-7,12-15H2,1-4H3,(H,24,27);5-8,15-17,19,21,24H,9-14H2,1-4H3,(H,23,26);4-5,10-12,22H,6-9H2,1-3H3,(H,21,24);3-4,9-11,22H,5-8H2,1-2H3,(H,21,24)
InChIKeyYTEBRMCFMDTTBV-UHFFFAOYSA-N
MW2714.30 g/mol
LogP22.36
Rot. Bonds31

About N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide

N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide (PubChem CID 162008633) has the molecular formula C125H179F10N19O24S6 and a molecular weight of 2714.30 g/mol. Its IUPAC name is N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide
PubChem CID162008633
Molecular FormulaC125H179F10N19O24S6
Molecular Weight2714.30 g/mol
Exact Mass2712.15
IUPAC NameN-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide
SMILESCC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(F)c(OC(F)(F)F)c2)CC1.CC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc3c(c2)C(=O)N(c2ccc(C(F)(F)F)cc2)C3=O)CC1.CC1CC(C)CC(c2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)C1.CC1CC(Oc2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)CC(C)O1.CC1CCCC(c2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)C1C.COc1cc(NC(=O)N2CCC(NS(=O)(=O)C(C)C)CC2)ccc1C(F)(F)F
InChIInChI=1S/C24H25F3N4O5S.2C23H37N3O3S.C22H35N3O5S.C17H24F3N3O4S.C16H21F4N3O4S/c1-14(2)37(35,36)29-16-9-11-30(12-10-16)23(34)28-17-5-8-19-20(13-17)22(33)31(21(19)32)18-6-3-15(4-7-18)24(25,26)27;1-16(2)30(28,29)25-22-9-11-26(12-10-22)23(27)24-21-7-5-19(6-8-21)20-14-17(3)13-18(4)15-20;1-16(2)30(28,29)25-21-12-14-26(15-13-21)23(27)24-20-10-8-19(9-11-20)22-7-5-6-17(3)18(22)4;1-15(2)31(27,28)24-19-9-11-25(12-10-19)22(26)23-18-5-7-20(8-6-18)30-21-13-16(3)29-17(4)14-21;1-11(2)28(25,26)22-12-6-8-23(9-7-12)16(24)21-13-4-5-14(17(18,19)20)15(10-13)27-3;1-10(2)28(25,26)22-11-5-7-23(8-6-11)15(24)21-12-3-4-13(17)14(9-12)27-16(18,19)20/h3-8,13-14,16,29H,9-12H2,1-2H3,(H,28,34);5-8,16-18,20,22,25H,9-15H2,1-4H3,(H,24,27);8-11,16-18,21-22,25H,5-7,12-15H2,1-4H3,(H,24,27);5-8,15-17,19,21,24H,9-14H2,1-4H3,(H,23,26);4-5,10-12,22H,6-9H2,1-3H3,(H,21,24);3-4,9-11,22H,5-8H2,1-2H3,(H,21,24)
InChIKeyYTEBRMCFMDTTBV-UHFFFAOYSA-N
XLogP22.36
TPSA545.36 Ų
H-Bond Donors12
H-Bond Acceptors24
Rotatable Bonds31
Heavy Atoms184
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002714.30
LogP ≤ 522.36
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide?
The IUPAC name of N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide (CID 162008633) is N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide.
What is the SMILES notation for N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide?
The canonical SMILES for N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide is CC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc(F)c(OC(F)(F)F)c2)CC1.CC(C)S(=O)(=O)NC1CCN(C(=O)Nc2ccc3c(c2)C(=O)N(c2ccc(C(F)(F)F)cc2)C3=O)CC1.CC1CC(C)CC(c2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)C1.CC1CC(Oc2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)CC(C)O1.CC1CCCC(c2ccc(NC(=O)N3CCC(NS(=O)(=O)C(C)C)CC3)cc2)C1C.COc1cc(NC(=O)N2CCC(NS(=O)(=O)C(C)C)CC2)ccc1C(F)(F)F.
What is the InChIKey of N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide?
The InChIKey is YTEBRMCFMDTTBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25F3N4O5S.2C23H37N3O3S.C22H35N3O5S.C17H24F3N3O4S.C16H21F4N3O4S/c1-14(2)37(35,36)29-16-9-11-30(12-10-16)23(34)28-17-5-8-19-20(13-17)22(33)31(21(19)32)18-6-3-15(4-7-18)24(25,26)27;1-16(2)30(28,29)25-22-9-11-26(12-10-22)23(27)24-21-7-5-19(6-8-21)20-14-17(3)13-18(4)15-20;1-16(2)30(28,29)25-21-12-14-26(15-13-21)23(27)24-20-10-8-19(9-11-20)22-7-5-6-17(3)18(22)4;1-15(2)31(27,28)24-19-9-11-25(12-10-19)22(26)23-18-5-7-20(8-6-18)30-21-13-16(3)29-17(4)14-21;1-11(2)28(25,26)22-12-6-8-23(9-7-12)16(24)21-13-4-5-14(17(18,19)20)15(10-13)27-3;1-10(2)28(25,26)22-11-5-7-23(8-6-11)15(24)21-12-3-4-13(17)14(9-12)27-16(18,19)20/h3-8,13-14,16,29H,9-12H2,1-2H3,(H,28,34);5-8,16-18,20,22,25H,9-15H2,1-4H3,(H,24,27);8-11,16-18,21-22,25H,5-7,12-15H2,1-4H3,(H,24,27);5-8,15-17,19,21,24H,9-14H2,1-4H3,(H,23,26);4-5,10-12,22H,6-9H2,1-3H3,(H,21,24);3-4,9-11,22H,5-8H2,1-2H3,(H,21,24).
What are the key properties of N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide?
N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide has a molecular weight of 2714.30 g/mol, XLogP of 22.36, 31 rotatable bonds, 12 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,3-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(3,5-dimethylcyclohexyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[1,3-dioxo-2-[4-(trifluoromethyl)phenyl]isoindol-5-yl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[4-fluoro-3-(trifluoromethoxy)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide;N-[3-methoxy-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide is sourced from PubChem (CID 162008633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).