7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole

C14H11FN2O — CID 117182002

IUPAC7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole
SMILESFc1cccc2c(COc3cccnc3)c[nH]c12
InChIInChI=1S/C14H11FN2O/c15-13-5-1-4-12-10(7-17-14(12)13)9-18-11-3-2-6-16-8-11/h1-8,17H,9H2
InChIKeyJCZSBUJHNVQKRB-UHFFFAOYSA-N
MW242.25 g/mol
LogP3.28
Rot. Bonds3

About 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole

7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole (PubChem CID 117182002) has the molecular formula C14H11FN2O and a molecular weight of 242.25 g/mol. Its IUPAC name is 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole.

Molecular Properties

Compound Name7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole
PubChem CID117182002
Molecular FormulaC14H11FN2O
Molecular Weight242.25 g/mol
Exact Mass242.09
IUPAC Name7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole
SMILESFc1cccc2c(COc3cccnc3)c[nH]c12
InChIInChI=1S/C14H11FN2O/c15-13-5-1-4-12-10(7-17-14(12)13)9-18-11-3-2-6-16-8-11/h1-8,17H,9H2
InChIKeyJCZSBUJHNVQKRB-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

3-(pyridin-3-yloxymethyl)-1H-indol-7-amine
CID 117182000
7-fluoro-3-[[4-(trifluoromethyl)phenoxy]methyl]-1H-indole
CID 117181955
6-methyl-3-(pyridin-3-yloxymethyl)-1H-indole
CID 117185687
3-[(4-fluorophenoxy)methyl]-7-methyl-1H-indole
CID 117186238
3-[(3-hydroxyphenoxy)methyl]-1H-indol-7-ol
CID 117181938
3-(phenoxymethyl)-1H-indol-7-amine
CID 117181852
O-[2-(7-fluoro-1H-indol-3-yl)ethyl]hydroxylamine
CID 83484408
3-[(4-fluoro-1-benzofuran-2-yl)methoxy]pyridine
CID 117172370
3-(pyridin-3-yloxymethyl)-1H-indole-4-carboxylic acid
CID 117171587
1-(7-fluoro-1H-indol-3-yl)-2-methylpropan-2-ol
CID 117197609
5-[(2,3-difluorophenyl)methoxy]-2-fluoropyridine
CID 115371725
3-butyl-7-fluoro-1H-indole
CID 106985261

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole?
The IUPAC name of 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole (CID 117182002) is 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole.
What is the SMILES notation for 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole?
The canonical SMILES for 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole is Fc1cccc2c(COc3cccnc3)c[nH]c12.
What is the InChIKey of 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole?
The InChIKey is JCZSBUJHNVQKRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O/c15-13-5-1-4-12-10(7-17-14(12)13)9-18-11-3-2-6-16-8-11/h1-8,17H,9H2.
What are the key properties of 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole?
7-fluoro-3-(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 7-fluoro-3-(pyridin-3-yloxymethyl)-1H-indole is sourced from PubChem (CID 117182002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).