bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine

C127H167N15O5 — CID 159732705

About bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine

bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine (PubChem CID 159732705) has the molecular formula C127H167N15O5 and a molecular weight of 1983.83 g/mol. Its IUPAC name is bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine.

Molecular Properties

• Compound Name: bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine
• PubChem CID: 159732705
• Molecular Formula: C127H167N15O5
• Molecular Weight: 1983.83 g/mol
• Exact Mass: 1982.33
• IUPAC Name: bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine
• SMILES: C1=C(CC2CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC2)Cc2ccccc21.c1ccc2c(c1)CC(CC1CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC1)C2.c1ccc2c(c1)CC(CC1CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC1)C2.c1ccc2c(c1)CC[C@@H](CC1CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC1)C2.c1ccc2c(c1)CC[C@H](CC1CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC1)C2
• InChI: InChI=1S/2C26H35N3O.2C25H33N3O.C25H31N3O/c2*1-2-5-23-15-21(7-8-22(23)4-1)14-20-9-12-29(13-10-20)25-16-26(18-27-17-25)30-19-24-6-3-11-28-24;3*1-2-5-22-14-20(13-21(22)4-1)12-19-7-10-28(11-8-19)24-15-25(17-26-16-24)29-18-23-6-3-9-27-23/h2*1-2,4-5,16-18,20-21,24,28H,3,6-15,19H2;2*1-2,4-5,15-17,19-20,23,27H,3,6-14,18H2;1-2,4-5,13,15-17,19,23,27H,3,6-12,14,18H2/t21-,24+;21-,24-;3*23-/m10000/s1
• InChIKey: NBKZSBLNKUBUOU-XWTBNNBWSA-N
• XLogP: 22.17
• TPSA: 186.95 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 20
• Rotatable Bonds: 30
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1983.83
LogP ≤ 5	22.17
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine?

The IUPAC name of bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine (CID 159732705) is bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine.

What is the SMILES notation for bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine?

The canonical SMILES for bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine is C1=C(CC2CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC2)Cc2ccccc21.c1ccc2c(c1)CC(CC1CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC1)C2.c1ccc2c(c1)CC(CC1CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC1)C2.c1ccc2c(c1)CC[C@@H](CC1CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC1)C2.c1ccc2c(c1)CC[C@H](CC1CCN(c3cncc(OC[C@@H]4CCCN4)c3)CC1)C2.

What is the InChIKey of bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine?

The InChIKey is NBKZSBLNKUBUOU-XWTBNNBWSA-N. The full InChI is InChI=1S/2C26H35N3O.2C25H33N3O.C25H31N3O/c2*1-2-5-23-15-21(7-8-22(23)4-1)14-20-9-12-29(13-10-20)25-16-26(18-27-17-25)30-19-24-6-3-11-28-24;3*1-2-5-22-14-20(13-21(22)4-1)12-19-7-10-28(11-8-19)24-15-25(17-26-16-24)29-18-23-6-3-9-27-23/h2*1-2,4-5,16-18,20-21,24,28H,3,6-15,19H2;2*1-2,4-5,15-17,19-20,23,27H,3,6-14,18H2;1-2,4-5,13,15-17,19,23,27H,3,6-12,14,18H2/t21-,24+;21-,24-;3*23-/m10000/s1.

What are the key properties of bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine?

bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine has a molecular weight of 1983.83 g/mol, XLogP of 22.17, 30 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for bis(3-[4-(2,3-dihydro-1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine);3-[4-(1H-inden-2-ylmethyl)piperidin-1-yl]-5-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine;3-[[(2S)-pyrrolidin-2-yl]methoxy]-5-[4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]piperidin-1-yl]pyridine is sourced from PubChem (CID 159732705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).