4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine

C14H17FN2O — CID 117171192

IUPAC4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine
SMILESCn1cc(CN2CCOCC2)c2c(F)cccc21
InChIInChI=1S/C14H17FN2O/c1-16-9-11(10-17-5-7-18-8-6-17)14-12(15)3-2-4-13(14)16/h2-4,9H,5-8,10H2,1H3
InChIKeyGYHCLXNKALICII-UHFFFAOYSA-N
MW248.30 g/mol
LogP2.15
Rot. Bonds2

About 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine

4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine (PubChem CID 117171192) has the molecular formula C14H17FN2O and a molecular weight of 248.30 g/mol. Its IUPAC name is 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine
PubChem CID117171192
Molecular FormulaC14H17FN2O
Molecular Weight248.30 g/mol
Exact Mass248.13
IUPAC Name4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine
SMILESCn1cc(CN2CCOCC2)c2c(F)cccc21
InChIInChI=1S/C14H17FN2O/c1-16-9-11(10-17-5-7-18-8-6-17)14-12(15)3-2-4-13(14)16/h2-4,9H,5-8,10H2,1H3
InChIKeyGYHCLXNKALICII-UHFFFAOYSA-N
XLogP2.15
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-bromo-1-methylindol-3-yl)methyl]morpholine
CID 117171194
4-[(1-methylindol-3-yl)methyl]morpholine
CID 15496284
4-[[1-[(2,3-difluorophenyl)methyl]piperidin-4-yl]methyl]morpholine
CID 51086748
[1-methyl-3-(piperidin-1-ylmethyl)indol-4-yl]methanamine
CID 117171054
4-[(3-bromo-2-fluorophenyl)methyl]morpholine
CID 70699667
4-chloro-1-methyl-3-(piperazin-1-ylmethyl)indole
CID 82666815
3-(azepan-1-ylmethyl)-1-methylindole-4-carboxylic acid
CID 117171543
4-[4-[(2,3-difluorophenyl)methyl]piperazin-1-yl]sulfonylmorpholine
CID 39998547
4-fluoro-1-methyl-3-(propan-2-ylsulfonylmethyl)indole
CID 117171230
1-methyl-3-(morpholin-4-ylmethyl)indole-5-carboxylic acid
CID 117175278
4-[(1-methyl-6-nitrosoindol-3-yl)methyl]morpholine
CID 89110009
1-[(2,3-difluorophenyl)methyl]azetidine
CID 126989798

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine?
The IUPAC name of 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine (CID 117171192) is 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine.
What is the SMILES notation for 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine?
The canonical SMILES for 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine is Cn1cc(CN2CCOCC2)c2c(F)cccc21.
What is the InChIKey of 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine?
The InChIKey is GYHCLXNKALICII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O/c1-16-9-11(10-17-5-7-18-8-6-17)14-12(15)3-2-4-13(14)16/h2-4,9H,5-8,10H2,1H3.
What are the key properties of 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine?
4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine has a molecular weight of 248.30 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluoro-1-methylindol-3-yl)methyl]morpholine is sourced from PubChem (CID 117171192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).