6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole

C14H11FN2O — CID 117180276

IUPAC6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole
SMILESFc1ccc2cc(COc3cccnc3)[nH]c2c1
InChIInChI=1S/C14H11FN2O/c15-11-4-3-10-6-12(17-14(10)7-11)9-18-13-2-1-5-16-8-13/h1-8,17H,9H2
InChIKeyVJIJCBSMFVVBJQ-UHFFFAOYSA-N
MW242.25 g/mol
LogP3.28
Rot. Bonds3

About 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole

6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole (PubChem CID 117180276) has the molecular formula C14H11FN2O and a molecular weight of 242.25 g/mol. Its IUPAC name is 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole.

Molecular Properties

Compound Name6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole
PubChem CID117180276
Molecular FormulaC14H11FN2O
Molecular Weight242.25 g/mol
Exact Mass242.09
IUPAC Name6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole
SMILESFc1ccc2cc(COc3cccnc3)[nH]c2c1
InChIInChI=1S/C14H11FN2O/c15-11-4-3-10-6-12(17-14(10)7-11)9-18-13-2-1-5-16-8-13/h1-8,17H,9H2
InChIKeyVJIJCBSMFVVBJQ-UHFFFAOYSA-N
XLogP3.28
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.25
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2-(pyridin-3-yloxymethyl)-1H-indole
CID 117185410
2-[(6-fluoro-1H-indol-2-yl)methoxy]phenol
CID 117180167
2-[(3-fluorophenoxy)methyl]-1H-indole
CID 117173285
3-[(3-fluorophenyl)methoxy]pyridine
CID 18758418
2-[(3-hydroxyphenoxy)methyl]-1H-indol-6-ol
CID 117180212
4-fluoro-2-(pyridin-3-yloxymethyl)benzonitrile
CID 114014859
2-[(2-fluorophenoxy)methyl]-1H-indol-6-ol
CID 117180148
2-[(2-fluorophenoxy)methyl]-6-methyl-1H-indole
CID 117185935
6-bromo-2-[(3-methylphenoxy)methyl]-1H-indole
CID 117180187
2-[(3-hydroxyphenoxy)methyl]-1H-indole-6-carboxylic acid
CID 117180415
5-[(3-fluorophenoxy)methyl]-2-(4-fluorophenyl)-1H-imidazole
CID 70277735
7-fluoro-1-methyl-2-(pyridin-3-yloxymethyl)indole
CID 117183745

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole?
The IUPAC name of 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole (CID 117180276) is 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole.
What is the SMILES notation for 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole?
The canonical SMILES for 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole is Fc1ccc2cc(COc3cccnc3)[nH]c2c1.
What is the InChIKey of 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole?
The InChIKey is VJIJCBSMFVVBJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O/c15-11-4-3-10-6-12(17-14(10)7-11)9-18-13-2-1-5-16-8-13/h1-8,17H,9H2.
What are the key properties of 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole?
6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole has a molecular weight of 242.25 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-(pyridin-3-yloxymethyl)-1H-indole is sourced from PubChem (CID 117180276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).