1-(2-pyridin-4-ylethyl)-2,3-dihydroindole

C15H16N2 — CID 25056

IUPAC1-(2-pyridin-4-ylethyl)-2,3-dihydroindole
SMILESc1ccc2c(c1)CCN2CCc1ccncc1
InChIInChI=1S/C15H16N2/c1-2-4-15-14(3-1)8-12-17(15)11-7-13-5-9-16-10-6-13/h1-6,9-10H,7-8,11-12H2
InChIKeyFTGIWLFSDZPQIO-UHFFFAOYSA-N
MW224.31 g/mol
LogP2.69
Rot. Bonds3

About 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole

1-(2-pyridin-4-ylethyl)-2,3-dihydroindole (PubChem CID 25056) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole.

Molecular Properties

Compound Name1-(2-pyridin-4-ylethyl)-2,3-dihydroindole
PubChem CID25056
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC Name1-(2-pyridin-4-ylethyl)-2,3-dihydroindole
SMILESc1ccc2c(c1)CCN2CCc1ccncc1
InChIInChI=1S/C15H16N2/c1-2-4-15-14(3-1)8-12-17(15)11-7-13-5-9-16-10-6-13/h1-6,9-10H,7-8,11-12H2
InChIKeyFTGIWLFSDZPQIO-UHFFFAOYSA-N
XLogP2.69
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydroindol-1-yl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 109001520
N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenylethanamine
CID 54806649
1-(2-iodoethyl)-2,3-dihydroindole
CID 131082836
2-(2,3-dihydroindol-1-yl)ethanamine
CID 1072384
2-(2,3-dihydroindol-1-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 47389879
N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide
CID 110620139
2-(2,3-dihydroindol-1-yl)ethanol;hydrochloride
CID 169005265
1-butyl-2,3-dihydroindole
CID 4167209
1-[2-(azepan-1-yl)ethyl]-2,3-dihydroindole
CID 54806650
1-(3-methylbutyl)-2,3-dihydroindole
CID 143815180
1-(chloromethyl)-2,3-dihydroindole
CID 59108457
N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-thiophen-3-ylethanamine
CID 55085249

Frequently Asked Questions

What is the IUPAC name of 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole?
The IUPAC name of 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole (CID 25056) is 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole.
What is the SMILES notation for 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole?
The canonical SMILES for 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole is c1ccc2c(c1)CCN2CCc1ccncc1.
What is the InChIKey of 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole?
The InChIKey is FTGIWLFSDZPQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2/c1-2-4-15-14(3-1)8-12-17(15)11-7-13-5-9-16-10-6-13/h1-6,9-10H,7-8,11-12H2.
What are the key properties of 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole?
1-(2-pyridin-4-ylethyl)-2,3-dihydroindole has a molecular weight of 224.31 g/mol, XLogP of 2.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyridin-4-ylethyl)-2,3-dihydroindole is sourced from PubChem (CID 25056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).