2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine

C16H15Cl2FN2 — CID 103494477

IUPAC2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
SMILESNCC(c1c(Cl)cccc1Cl)N1CCc2ccc(F)cc21
InChIInChI=1S/C16H15Cl2FN2/c17-12-2-1-3-13(18)16(12)15(9-20)21-7-6-10-4-5-11(19)8-14(10)21/h1-5,8,15H,6-7,9,20H2
InChIKeyFFPCZSRIJXWDNX-UHFFFAOYSA-N
MW325.21 g/mol
LogP4.20
Rot. Bonds3

About 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine

2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine (PubChem CID 103494477) has the molecular formula C16H15Cl2FN2 and a molecular weight of 325.21 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
PubChem CID103494477
Molecular FormulaC16H15Cl2FN2
Molecular Weight325.21 g/mol
Exact Mass324.06
IUPAC Name2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
SMILESNCC(c1c(Cl)cccc1Cl)N1CCc2ccc(F)cc21
InChIInChI=1S/C16H15Cl2FN2/c17-12-2-1-3-13(18)16(12)15(9-20)21-7-6-10-4-5-11(19)8-14(10)21/h1-5,8,15H,6-7,9,20H2
InChIKeyFFPCZSRIJXWDNX-UHFFFAOYSA-N
XLogP4.20
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.21
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chloro-5-fluorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494431
3-amino-2-(6-fluoro-2,3-dihydroindol-1-yl)propanoic acid
CID 103494512
[2-chloro-6-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]methanamine
CID 103494043
2-(4,5-dibromofuran-2-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494492
2-(3-bromofuran-2-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 106885883
1-(3-chlorophenyl)-1-(6-fluoro-2,3-dihydroindol-1-yl)propan-2-amine
CID 103494129
2-(6-fluoro-2,3-dihydroindol-1-yl)-N-methyl-2-phenylethanamine
CID 103503159
2-(6-fluoro-2,3-dihydroindol-1-yl)-2-(4-methyl-3-pyridinyl)ethanamine
CID 103494389
2-(1,3-dimethylpyrazol-4-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494548
2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494523
2-(6-fluoro-2,3-dihydroindol-1-yl)-5-methylsulfanylpentan-1-amine
CID 103494475
3-chloro-2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]phenol
CID 103504803

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine?
The IUPAC name of 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine (CID 103494477) is 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine is NCC(c1c(Cl)cccc1Cl)N1CCc2ccc(F)cc21.
What is the InChIKey of 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine?
The InChIKey is FFPCZSRIJXWDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2FN2/c17-12-2-1-3-13(18)16(12)15(9-20)21-7-6-10-4-5-11(19)8-14(10)21/h1-5,8,15H,6-7,9,20H2.
What are the key properties of 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine?
2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine has a molecular weight of 325.21 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine is sourced from PubChem (CID 103494477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).