5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole

C23H25N3 — CID 68854814

IUPAC5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole
SMILESC1=C(c2ccc3[nH]ccc3c2)CCN(CCC2CNc3ccccc32)C1
InChIInChI=1S/C23H25N3/c1-2-4-23-21(3-1)20(16-25-23)10-14-26-12-8-17(9-13-26)18-5-6-22-19(15-18)7-11-24-22/h1-8,11,15,20,24-25H,9-10,12-14,16H2
InChIKeyOLDRWPPUHSVYLU-UHFFFAOYSA-N
MW343.47 g/mol
LogP4.86
Rot. Bonds4

About 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole

5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole (PubChem CID 68854814) has the molecular formula C23H25N3 and a molecular weight of 343.47 g/mol. Its IUPAC name is 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole.

Molecular Properties

Compound Name5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole
PubChem CID68854814
Molecular FormulaC23H25N3
Molecular Weight343.47 g/mol
Exact Mass343.20
IUPAC Name5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole
SMILESC1=C(c2ccc3[nH]ccc3c2)CCN(CCC2CNc3ccccc32)C1
InChIInChI=1S/C23H25N3/c1-2-4-23-21(3-1)20(16-25-23)10-14-26-12-8-17(9-13-26)18-5-6-22-19(15-18)7-11-24-22/h1-8,11,15,20,24-25H,9-10,12-14,16H2
InChIKeyOLDRWPPUHSVYLU-UHFFFAOYSA-N
XLogP4.86
TPSA31.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole?
The IUPAC name of 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole (CID 68854814) is 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole.
What is the SMILES notation for 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole?
The canonical SMILES for 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole is C1=C(c2ccc3[nH]ccc3c2)CCN(CCC2CNc3ccccc32)C1.
What is the InChIKey of 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole?
The InChIKey is OLDRWPPUHSVYLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3/c1-2-4-23-21(3-1)20(16-25-23)10-14-26-12-8-17(9-13-26)18-5-6-22-19(15-18)7-11-24-22/h1-8,11,15,20,24-25H,9-10,12-14,16H2.
What are the key properties of 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole?
5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole has a molecular weight of 343.47 g/mol, XLogP of 4.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole is sourced from PubChem (CID 68854814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).