5-(2-pyridin-4-ylethoxy)-1H-indole

C15H14N2O — CID 80643578

IUPAC5-(2-pyridin-4-ylethoxy)-1H-indole
SMILESc1cc(CCOc2ccc3[nH]ccc3c2)ccn1
InChIInChI=1S/C15H14N2O/c1-2-15-13(5-9-17-15)11-14(1)18-10-6-12-3-7-16-8-4-12/h1-5,7-9,11,17H,6,10H2
InChIKeyZVPRCPCVFHHNBC-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.18
Rot. Bonds4

About 5-(2-pyridin-4-ylethoxy)-1H-indole

5-(2-pyridin-4-ylethoxy)-1H-indole (PubChem CID 80643578) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-(2-pyridin-4-ylethoxy)-1H-indole.

Molecular Properties

Compound Name5-(2-pyridin-4-ylethoxy)-1H-indole
PubChem CID80643578
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name5-(2-pyridin-4-ylethoxy)-1H-indole
SMILESc1cc(CCOc2ccc3[nH]ccc3c2)ccn1
InChIInChI=1S/C15H14N2O/c1-2-15-13(5-9-17-15)11-14(1)18-10-6-12-3-7-16-8-4-12/h1-5,7-9,11,17H,6,10H2
InChIKeyZVPRCPCVFHHNBC-UHFFFAOYSA-N
XLogP3.18
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1H-indol-5-yloxy)propan-1-amine
CID 84662713
2-(1H-indol-5-yloxy)ethanamine
CID 84655544
5-heptoxy-1H-indole
CID 80642434
5-[2-(4-bromophenoxy)ethoxy]-1H-indole
CID 80640825
5-pent-4-ynoxy-1H-indole
CID 112548784
[2-fluoro-4-(2-pyridin-4-ylethoxy)phenyl]borane
CID 88897064
4-(1H-indol-5-yloxymethyl)pyridine-2-carbonitrile
CID 80643657
5-(2-ethylsulfanylethoxy)-1H-indole
CID 115967778
5-[2-(2-methylimidazol-1-yl)ethoxy]-1H-indole
CID 80640824
4-[4-[2-(1H-indol-5-yl)ethoxy]phenyl]butan-2-one
CID 175853816
4-(1H-indol-5-yloxymethyl)phenol
CID 80641928
4-[2-(4-methylphenoxy)ethyl]pyridine
CID 64763978

Frequently Asked Questions

What is the IUPAC name of 5-(2-pyridin-4-ylethoxy)-1H-indole?
The IUPAC name of 5-(2-pyridin-4-ylethoxy)-1H-indole (CID 80643578) is 5-(2-pyridin-4-ylethoxy)-1H-indole.
What is the SMILES notation for 5-(2-pyridin-4-ylethoxy)-1H-indole?
The canonical SMILES for 5-(2-pyridin-4-ylethoxy)-1H-indole is c1cc(CCOc2ccc3[nH]ccc3c2)ccn1.
What is the InChIKey of 5-(2-pyridin-4-ylethoxy)-1H-indole?
The InChIKey is ZVPRCPCVFHHNBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-2-15-13(5-9-17-15)11-14(1)18-10-6-12-3-7-16-8-4-12/h1-5,7-9,11,17H,6,10H2.
What are the key properties of 5-(2-pyridin-4-ylethoxy)-1H-indole?
5-(2-pyridin-4-ylethoxy)-1H-indole has a molecular weight of 238.29 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-pyridin-4-ylethoxy)-1H-indole is sourced from PubChem (CID 80643578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).