5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole

C16H22N2 — CID 124501023

IUPAC5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole
SMILESCC(C)N1CCCC[C@@H]1c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H22N2/c1-12(2)18-10-4-3-5-16(18)14-6-7-15-13(11-14)8-9-17-15/h6-9,11-12,16-17H,3-5,10H2,1-2H3/t16-/m1/s1
InChIKeyFFOJICNBMZFVQU-MRXNPFEDSA-N
MW242.37 g/mol
LogP4.10
Rot. Bonds2

About 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole

5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole (PubChem CID 124501023) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole.

Molecular Properties

Compound Name5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole
PubChem CID124501023
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole
SMILESCC(C)N1CCCC[C@@H]1c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H22N2/c1-12(2)18-10-4-3-5-16(18)14-6-7-15-13(11-14)8-9-17-15/h6-9,11-12,16-17H,3-5,10H2,1-2H3/t16-/m1/s1
InChIKeyFFOJICNBMZFVQU-MRXNPFEDSA-N
XLogP4.10
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-[(2S)-1-methylpiperidin-2-yl]-1H-indole
CID 95732626
2-(1H-indol-5-yl)piperidine-1-carbaldehyde
CID 102544412
(2R)-2-(4-fluorophenyl)-1-propan-2-ylpiperidine
CID 124501109
5-[1-[(3-methylphenyl)methyl]piperidin-2-yl]-1H-indole
CID 174724025
(2S)-2-phenyl-1-propan-2-ylpiperidine
CID 140931618
3-methyl-5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-pyridin-2-one
CID 129370336
2-(1H-indol-5-yl)-4-propan-2-ylpiperazine-1-carbaldehyde
CID 87692327
2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine
CID 167249235
5-(4-methylcyclohexyl)-1H-indole
CID 69051193
N-ethyl-N-methyl-5-(1-propan-2-ylpiperidin-2-yl)pyridin-2-amine
CID 102539854
N-(1H-indol-5-ylmethyl)-1-propan-2-ylpiperidin-4-amine
CID 102909363
N-cyclopentyl-5-(1-propan-2-ylpyrrolidin-2-yl)pyridin-2-amine
CID 102540450

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole?
The IUPAC name of 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole (CID 124501023) is 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole.
What is the SMILES notation for 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole?
The canonical SMILES for 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole is CC(C)N1CCCC[C@@H]1c1ccc2[nH]ccc2c1.
What is the InChIKey of 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole?
The InChIKey is FFOJICNBMZFVQU-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H22N2/c1-12(2)18-10-4-3-5-16(18)14-6-7-15-13(11-14)8-9-17-15/h6-9,11-12,16-17H,3-5,10H2,1-2H3/t16-/m1/s1.
What are the key properties of 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole?
5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole has a molecular weight of 242.37 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole is sourced from PubChem (CID 124501023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).