1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine

C110H148FN21 — CID 158437575

IUPAC1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine
SMILESCC(C)N1CCN(CCNC2CCN(c3cccc(-c4cc5cc(N=[N+]=[N-])ccc5[nH]4)c3)CC2)CC1.CCN1CCN(CCNC2CCN(c3cccc(C4=Cc5ccccc5C4)c3)CC2)CC1.CN1CCC(NC2CCN(c3cccc(-c4cc5cc(F)ccc5[nH]4)c3)CC2)CC1.Cc1ccc2[nH]c(-c3cccc(N4CCC(NCCN5CCN(C(C)C)CC5)CC4)c3)cc2c1
InChIInChI=1S/C29H41N5.C28H38N8.C28H38N4.C25H31FN4/c1-22(2)33-17-15-32(16-18-33)14-11-30-26-9-12-34(13-10-26)27-6-4-5-24(20-27)29-21-25-19-23(3)7-8-28(25)31-29;1-21(2)35-16-14-34(15-17-35)13-10-30-24-8-11-36(12-9-24)26-5-3-4-22(19-26)28-20-23-18-25(32-33-29)6-7-27(23)31-28;1-2-30-16-18-31(19-17-30)15-12-29-27-10-13-32(14-11-27)28-9-5-8-25(22-28)26-20-23-6-3-4-7-24(23)21-26;1-29-11-7-21(8-12-29)27-22-9-13-30(14-10-22)23-4-2-3-18(16-23)25-17-19-15-20(26)5-6-24(19)28-25/h4-8,19-22,26,30-31H,9-18H2,1-3H3;3-7,18-21,24,30-31H,8-17H2,1-2H3;3-9,20,22,27,29H,2,10-19,21H2,1H3;2-6,15-17,21-22,27-28H,7-14H2,1H3
InChIKeyHCKPWNHBRDUDCM-UHFFFAOYSA-N
MW1783.54 g/mol
LogP18.69
Rot. Bonds26

About 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine

1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine (PubChem CID 158437575) has the molecular formula C110H148FN21 and a molecular weight of 1783.54 g/mol. Its IUPAC name is 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine
PubChem CID158437575
Molecular FormulaC110H148FN21
Molecular Weight1783.54 g/mol
Exact Mass1782.22
IUPAC Name1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine
SMILESCC(C)N1CCN(CCNC2CCN(c3cccc(-c4cc5cc(N=[N+]=[N-])ccc5[nH]4)c3)CC2)CC1.CCN1CCN(CCNC2CCN(c3cccc(C4=Cc5ccccc5C4)c3)CC2)CC1.CN1CCC(NC2CCN(c3cccc(-c4cc5cc(F)ccc5[nH]4)c3)CC2)CC1.Cc1ccc2[nH]c(-c3cccc(N4CCC(NCCN5CCN(C(C)C)CC5)CC4)c3)cc2c1
InChIInChI=1S/C29H41N5.C28H38N8.C28H38N4.C25H31FN4/c1-22(2)33-17-15-32(16-18-33)14-11-30-26-9-12-34(13-10-26)27-6-4-5-24(20-27)29-21-25-19-23(3)7-8-28(25)31-29;1-21(2)35-16-14-34(15-17-35)13-10-30-24-8-11-36(12-9-24)26-5-3-4-22(19-26)28-20-23-18-25(32-33-29)6-7-27(23)31-28;1-2-30-16-18-31(19-17-30)15-12-29-27-10-13-32(14-11-27)28-9-5-8-25(22-28)26-20-23-6-3-4-7-24(23)21-26;1-29-11-7-21(8-12-29)27-22-9-13-30(14-10-22)23-4-2-3-18(16-23)25-17-19-15-20(26)5-6-24(19)28-25/h4-8,19-22,26,30-31H,9-18H2,1-3H3;3-7,18-21,24,30-31H,8-17H2,1-2H3;3-9,20,22,27,29H,2,10-19,21H2,1H3;2-6,15-17,21-22,27-28H,7-14H2,1H3
InChIKeyHCKPWNHBRDUDCM-UHFFFAOYSA-N
XLogP18.69
TPSA179.89 Ų
H-Bond Donors7
H-Bond Acceptors16
Rotatable Bonds26
Heavy Atoms132
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001783.54
LogP ≤ 518.69
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine?
The IUPAC name of 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine (CID 158437575) is 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-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-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine?
The canonical SMILES for 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine is CC(C)N1CCN(CCNC2CCN(c3cccc(-c4cc5cc(N=[N+]=[N-])ccc5[nH]4)c3)CC2)CC1.CCN1CCN(CCNC2CCN(c3cccc(C4=Cc5ccccc5C4)c3)CC2)CC1.CN1CCC(NC2CCN(c3cccc(-c4cc5cc(F)ccc5[nH]4)c3)CC2)CC1.Cc1ccc2[nH]c(-c3cccc(N4CCC(NCCN5CCN(C(C)C)CC5)CC4)c3)cc2c1.
What is the InChIKey of 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine?
The InChIKey is HCKPWNHBRDUDCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H41N5.C28H38N8.C28H38N4.C25H31FN4/c1-22(2)33-17-15-32(16-18-33)14-11-30-26-9-12-34(13-10-26)27-6-4-5-24(20-27)29-21-25-19-23(3)7-8-28(25)31-29;1-21(2)35-16-14-34(15-17-35)13-10-30-24-8-11-36(12-9-24)26-5-3-4-22(19-26)28-20-23-18-25(32-33-29)6-7-27(23)31-28;1-2-30-16-18-31(19-17-30)15-12-29-27-10-13-32(14-11-27)28-9-5-8-25(22-28)26-20-23-6-3-4-7-24(23)21-26;1-29-11-7-21(8-12-29)27-22-9-13-30(14-10-22)23-4-2-3-18(16-23)25-17-19-15-20(26)5-6-24(19)28-25/h4-8,19-22,26,30-31H,9-18H2,1-3H3;3-7,18-21,24,30-31H,8-17H2,1-2H3;3-9,20,22,27,29H,2,10-19,21H2,1H3;2-6,15-17,21-22,27-28H,7-14H2,1H3.
What are the key properties of 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine?
1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine has a molecular weight of 1783.54 g/mol, XLogP of 18.69, 26 rotatable bonds, 7 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(5-azido-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine;N-[2-(4-ethylpiperazin-1-yl)ethyl]-1-[3-(1H-inden-2-yl)phenyl]piperidin-4-amine;N-[1-[3-(5-fluoro-1H-indol-2-yl)phenyl]piperidin-4-yl]-1-methylpiperidin-4-amine;1-[3-(5-methyl-1H-indol-2-yl)phenyl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]piperidin-4-amine is sourced from PubChem (CID 158437575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).