3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine

C18H17FN2 — CID 24887100

IUPAC3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CC(c2c[nH]c3ccc(F)cc23)c2ccccc21
InChIInChI=1S/C18H17FN2/c1-20-18-9-14(12-4-2-3-5-13(12)18)16-10-21-17-7-6-11(19)8-15(16)17/h2-8,10,14,18,20-21H,9H2,1H3
InChIKeySQGQTYGQLBRXLU-UHFFFAOYSA-N
MW280.35 g/mol
LogP4.10
Rot. Bonds2

About 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine

3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 24887100) has the molecular formula C18H17FN2 and a molecular weight of 280.35 g/mol. Its IUPAC name is 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine
PubChem CID24887100
Molecular FormulaC18H17FN2
Molecular Weight280.35 g/mol
Exact Mass280.14
IUPAC Name3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CC(c2c[nH]c3ccc(F)cc23)c2ccccc21
InChIInChI=1S/C18H17FN2/c1-20-18-9-14(12-4-2-3-5-13(12)18)16-10-21-17-7-6-11(19)8-15(16)17/h2-8,10,14,18,20-21H,9H2,1H3
InChIKeySQGQTYGQLBRXLU-UHFFFAOYSA-N
XLogP4.10
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine 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

(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 24887103
(1R,3S)-3-(7-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 24886833
3-(6-bromo-1H-indol-3-yl)-5-fluoro-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 24887355
(1S,3S)-3-(4-fluorophenyl)-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 59582051
2-(5-fluoro-1H-indol-3-yl)cyclobutan-1-one
CID 162402410
(1S,3S)-3-(3,4-difluorophenyl)-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 59582043
3-(4-chloro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;methane;3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(7-methyl-1H-indol-3-yl)-2,3-dihydro-1H-inden-1-amine
CID 160870491
3-(5-chloro-1H-indol-3-yl)-2,3-dihydro-1H-inden-1-ol
CID 68911432
N-[[2-(5-fluoro-1H-indol-3-yl)cyclopropyl]methyl]-3-methylbutan-1-amine
CID 22638713
(1S,3R)-3-(1H-indol-3-yl)-2,3-dihydro-1H-inden-1-amine
CID 69032046
(2S,4R)-1-benzyl-N-tert-butyl-4-(5-fluoro-1H-indol-3-yl)-5-oxopyrrolidine-2-carboxamide
CID 56648327
3-(1,4-dioxaspiro[4.5]decan-8-yl)-5-fluoro-1H-indole
CID 10564325

Frequently Asked Questions

What is the IUPAC name of 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine (CID 24887100) is 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine is CNC1CC(c2c[nH]c3ccc(F)cc23)c2ccccc21.
What is the InChIKey of 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is SQGQTYGQLBRXLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2/c1-20-18-9-14(12-4-2-3-5-13(12)18)16-10-21-17-7-6-11(19)8-15(16)17/h2-8,10,14,18,20-21H,9H2,1H3.
What are the key properties of 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine?
3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 280.35 g/mol, XLogP of 4.10, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluoro-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 24887100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).