6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine

C9H11FN2 — CID 84739527

IUPAC6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine
SMILESCNC1CNc2cc(F)ccc21
InChIInChI=1S/C9H11FN2/c1-11-9-5-12-8-4-6(10)2-3-7(8)9/h2-4,9,11-12H,5H2,1H3
InChIKeyDNURDVBCLJZJRH-UHFFFAOYSA-N
MW166.20 g/mol
LogP1.51
Rot. Bonds1

About 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine

6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine (PubChem CID 84739527) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine.

Molecular Properties

Compound Name6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine
PubChem CID84739527
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Name6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine
SMILESCNC1CNc2cc(F)ccc21
InChIInChI=1S/C9H11FN2/c1-11-9-5-12-8-4-6(10)2-3-7(8)9/h2-4,9,11-12H,5H2,1H3
InChIKeyDNURDVBCLJZJRH-UHFFFAOYSA-N
XLogP1.51
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine?
The IUPAC name of 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine (CID 84739527) is 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine.
What is the SMILES notation for 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine?
The canonical SMILES for 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine is CNC1CNc2cc(F)ccc21.
What is the InChIKey of 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine?
The InChIKey is DNURDVBCLJZJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2/c1-11-9-5-12-8-4-6(10)2-3-7(8)9/h2-4,9,11-12H,5H2,1H3.
What are the key properties of 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine?
6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine has a molecular weight of 166.20 g/mol, XLogP of 1.51, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine is sourced from PubChem (CID 84739527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).