1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine

C116H156FN15 — CID 158928981

IUPAC1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine
SMILESCC(C)N1CCC(NC2CCC(c3cccc(C4=Cc5cc(F)ccc5C4)c3)CC2)CC1.CC(C)N1CCN(CCNC2CCN(c3ccc4c(c3)C3=C(CC4)c4ccccc4C3)CC2)CC1.Cc1c(-c2cccc(N3CCC(NC4CCN(C)CC4)CC3)c2)[nH]c2ccccc12.Cc1ccc(N2CCC(NCCN3CCN(C(C)C)CC3)CC2)cc1-c1[nH]c2ccccc2c1C
InChIInChI=1S/C31H42N4.C30H43N5.C29H37FN2.C26H34N4/c1-23(2)34-19-17-33(18-20-34)16-13-32-26-11-14-35(15-12-26)27-9-7-24-8-10-29-28-6-4-3-5-25(28)21-31(29)30(24)22-27;1-22(2)34-19-17-33(18-20-34)16-13-31-25-11-14-35(15-12-25)26-10-9-23(3)28(21-26)30-24(4)27-7-5-6-8-29(27)32-30;1-20(2)32-14-12-29(13-15-32)31-28-10-7-21(8-11-28)22-4-3-5-23(16-22)25-17-24-6-9-27(30)19-26(24)18-25;1-19-24-8-3-4-9-25(24)28-26(19)20-6-5-7-23(18-20)30-16-12-22(13-17-30)27-21-10-14-29(2)15-11-21/h3-7,9,22-23,26,32H,8,10-21H2,1-2H3;5-10,21-22,25,31-32H,11-20H2,1-4H3;3-6,9,16,18-21,28-29,31H,7-8,10-15,17H2,1-2H3;3-9,18,21-22,27-28H,10-17H2,1-2H3
InChIKeyJIUNBJGFICCVLX-UHFFFAOYSA-N
MW1779.63 g/mol
LogP20.93
Rot. Bonds22

About 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine

1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine (PubChem CID 158928981) has the molecular formula C116H156FN15 and a molecular weight of 1779.63 g/mol. Its IUPAC name is 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine
PubChem CID158928981
Molecular FormulaC116H156FN15
Molecular Weight1779.63 g/mol
Exact Mass1778.27
IUPAC Name1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine
SMILESCC(C)N1CCC(NC2CCC(c3cccc(C4=Cc5cc(F)ccc5C4)c3)CC2)CC1.CC(C)N1CCN(CCNC2CCN(c3ccc4c(c3)C3=C(CC4)c4ccccc4C3)CC2)CC1.Cc1c(-c2cccc(N3CCC(NC4CCN(C)CC4)CC3)c2)[nH]c2ccccc12.Cc1ccc(N2CCC(NCCN3CCN(C(C)C)CC3)CC2)cc1-c1[nH]c2ccccc2c1C
InChIInChI=1S/C31H42N4.C30H43N5.C29H37FN2.C26H34N4/c1-23(2)34-19-17-33(18-20-34)16-13-32-26-11-14-35(15-12-26)27-9-7-24-8-10-29-28-6-4-3-5-25(28)21-31(29)30(24)22-27;1-22(2)34-19-17-33(18-20-34)16-13-31-25-11-14-35(15-12-25)26-10-9-23(3)28(21-26)30-24(4)27-7-5-6-8-29(27)32-30;1-20(2)32-14-12-29(13-15-32)31-28-10-7-21(8-11-28)22-4-3-5-23(16-22)25-17-24-6-9-27(30)19-26(24)18-25;1-19-24-8-3-4-9-25(24)28-26(19)20-6-5-7-23(18-20)30-16-12-22(13-17-30)27-21-10-14-29(2)15-11-21/h3-7,9,22-23,26,32H,8,10-21H2,1-2H3;5-10,21-22,25,31-32H,11-20H2,1-4H3;3-6,9,16,18-21,28-29,31H,7-8,10-15,17H2,1-2H3;3-9,18,21-22,27-28H,10-17H2,1-2H3
InChIKeyJIUNBJGFICCVLX-UHFFFAOYSA-N
XLogP20.93
TPSA108.86 Ų
H-Bond Donors6
H-Bond Acceptors13
Rotatable Bonds22
Heavy Atoms132
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001779.63
LogP ≤ 520.93
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

Analyze 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine?
The IUPAC name of 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine (CID 158928981) is 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine.
What is the SMILES notation for 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine?
The canonical SMILES for 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine is CC(C)N1CCC(NC2CCC(c3cccc(C4=Cc5cc(F)ccc5C4)c3)CC2)CC1.CC(C)N1CCN(CCNC2CCN(c3ccc4c(c3)C3=C(CC4)c4ccccc4C3)CC2)CC1.Cc1c(-c2cccc(N3CCC(NC4CCN(C)CC4)CC3)c2)[nH]c2ccccc12.Cc1ccc(N2CCC(NCCN3CCN(C(C)C)CC3)CC2)cc1-c1[nH]c2ccccc2c1C.
What is the InChIKey of 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine?
The InChIKey is JIUNBJGFICCVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H42N4.C30H43N5.C29H37FN2.C26H34N4/c1-23(2)34-19-17-33(18-20-34)16-13-32-26-11-14-35(15-12-26)27-9-7-24-8-10-29-28-6-4-3-5-25(28)21-31(29)30(24)22-27;1-22(2)34-19-17-33(18-20-34)16-13-31-25-11-14-35(15-12-25)26-10-9-23(3)28(21-26)30-24(4)27-7-5-6-8-29(27)32-30;1-20(2)32-14-12-29(13-15-32)31-28-10-7-21(8-11-28)22-4-3-5-23(16-22)25-17-24-6-9-27(30)19-26(24)18-25;1-19-24-8-3-4-9-25(24)28-26(19)20-6-5-7-23(18-20)30-16-12-22(13-17-30)27-21-10-14-29(2)15-11-21/h3-7,9,22-23,26,32H,8,10-21H2,1-2H3;5-10,21-22,25,31-32H,11-20H2,1-4H3;3-6,9,16,18-21,28-29,31H,7-8,10-15,17H2,1-2H3;3-9,18,21-22,27-28H,10-17H2,1-2H3.
What are the key properties of 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine?
1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine has a molecular weight of 1779.63 g/mol, XLogP of 20.93, 22 rotatable bonds, 6 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,11-dihydro-5H-benzo[a]fluoren-2-yl)-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[4-[3-(5-fluoro-1H-inden-2-yl)phenyl]cyclohexyl]-1-propan-2-ylpiperidin-4-amine;1-methyl-N-[1-[3-(3-methyl-1H-indol-2-yl)phenyl]piperidin-4-yl]piperidin-4-amine;1-[4-methyl-3-(3-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine is sourced from PubChem (CID 158928981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).