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

C23H27N3 — CID 68855989

IUPAC5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole
SMILESc1ccc2c(c1)NCC2CCN1CCC(c2ccc3[nH]ccc3c2)CC1
InChIInChI=1S/C23H27N3/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/h1-7,11,15,17,20,24-25H,8-10,12-14,16H2
InChIKeyFGSTVFAPTRPDCV-UHFFFAOYSA-N
MW345.49 g/mol
LogP4.95
Rot. Bonds4

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

5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole (PubChem CID 68855989) has the molecular formula C23H27N3 and a molecular weight of 345.49 g/mol. Its IUPAC name is 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole.

Molecular Properties

Compound Name5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole
PubChem CID68855989
Molecular FormulaC23H27N3
Molecular Weight345.49 g/mol
Exact Mass345.22
IUPAC Name5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole
SMILESc1ccc2c(c1)NCC2CCN1CCC(c2ccc3[nH]ccc3c2)CC1
InChIInChI=1S/C23H27N3/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/h1-7,11,15,17,20,24-25H,8-10,12-14,16H2
InChIKeyFGSTVFAPTRPDCV-UHFFFAOYSA-N
XLogP4.95
TPSA31.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.49
LogP ≤ 54.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-indole
CID 68854814
3-[2-(4-tert-butylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574620
3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574811
1,1,1-trifluoro-3-[4-(1H-indol-5-yl)piperidin-1-yl]propan-2-ol
CID 166265437
3-[2-(3-ethylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80576591
5-(4-methylcyclohexyl)-1H-indole
CID 69051193
3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574822
3-[2-(2,5-dimethylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80577266
1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]pyrrolidin-2-one
CID 24700363
3-[2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-2,3-dihydro-1H-indole
CID 114490137
2-(2,3-dihydro-1H-indol-3-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 80577284
7-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
CID 80575135

Frequently Asked Questions

What is the IUPAC name of 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole?
The IUPAC name of 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole (CID 68855989) is 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole.
What is the SMILES notation for 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole?
The canonical SMILES for 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole is c1ccc2c(c1)NCC2CCN1CCC(c2ccc3[nH]ccc3c2)CC1.
What is the InChIKey of 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole?
The InChIKey is FGSTVFAPTRPDCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3/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/h1-7,11,15,17,20,24-25H,8-10,12-14,16H2.
What are the key properties of 5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole?
5-[1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole has a molecular weight of 345.49 g/mol, XLogP of 4.95, 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]piperidin-4-yl]-1H-indole is sourced from PubChem (CID 68855989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).