5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole

C14H17FN2 — CID 54476619

IUPAC5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole
SMILESCN1CCC[C@@H]1Cc1c[nH]c2ccc(F)cc12
InChIInChI=1S/C14H17FN2/c1-17-6-2-3-12(17)7-10-9-16-14-5-4-11(15)8-13(10)14/h4-5,8-9,12,16H,2-3,6-7H2,1H3/t12-/m1/s1
InChIKeyXMAODTLZCWIQBA-GFCCVEGCSA-N
MW232.30 g/mol
LogP2.94
Rot. Bonds2

About 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole

5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole (PubChem CID 54476619) has the molecular formula C14H17FN2 and a molecular weight of 232.30 g/mol. Its IUPAC name is 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole.

Molecular Properties

Compound Name5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole
PubChem CID54476619
Molecular FormulaC14H17FN2
Molecular Weight232.30 g/mol
Exact Mass232.14
IUPAC Name5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole
SMILESCN1CCC[C@@H]1Cc1c[nH]c2ccc(F)cc12
InChIInChI=1S/C14H17FN2/c1-17-6-2-3-12(17)7-10-9-16-14-5-4-11(15)8-13(10)14/h4-5,8-9,12,16H,2-3,6-7H2,1H3/t12-/m1/s1
InChIKeyXMAODTLZCWIQBA-GFCCVEGCSA-N
XLogP2.94
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.30
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole
CID 15521562
3-[[(2S)-1-methylpyrrolidin-2-yl]methyl]-1H-indol-5-amine
CID 59715791
5-ethenyl-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole
CID 10220397
N,N-dibenzyl-3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indol-5-amine
CID 54377816
N-methyl-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole-5-sulfonamide
CID 163863896
[3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indol-5-yl]thiourea
CID 19040775
5-(2-ethylsulfonylethyl)-3-[(1-methylpyrrolidin-2-yl)methyl]-1H-indole
CID 19970230
3-[3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indol-5-yl]propanamide
CID 54079951
3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-(oxan-4-ylsulfanyl)-1H-indole
CID 176854776
2-methyl-5-[3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indol-5-yl]pentan-2-ol
CID 22870340
2-[3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indol-5-yl]ethanesulfonamide
CID 15840027
1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]guanidine;hydroiodide
CID 111972827

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole?
The IUPAC name of 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole (CID 54476619) is 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole.
What is the SMILES notation for 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole?
The canonical SMILES for 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole is CN1CCC[C@@H]1Cc1c[nH]c2ccc(F)cc12.
What is the InChIKey of 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole?
The InChIKey is XMAODTLZCWIQBA-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H17FN2/c1-17-6-2-3-12(17)7-10-9-16-14-5-4-11(15)8-13(10)14/h4-5,8-9,12,16H,2-3,6-7H2,1H3/t12-/m1/s1.
What are the key properties of 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole?
5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole has a molecular weight of 232.30 g/mol, XLogP of 2.94, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole is sourced from PubChem (CID 54476619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).