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

C16H23FN2 — CID 103494523

IUPAC2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
SMILESNCC(C1CCCCC1)N1CCc2ccc(F)cc21
InChIInChI=1S/C16H23FN2/c17-14-7-6-13-8-9-19(15(13)10-14)16(11-18)12-4-2-1-3-5-12/h6-7,10,12,16H,1-5,8-9,11,18H2
InChIKeyIWEOOXKJEZRKQH-UHFFFAOYSA-N
MW262.37 g/mol
LogP3.10
Rot. Bonds3

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

2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine (PubChem CID 103494523) has the molecular formula C16H23FN2 and a molecular weight of 262.37 g/mol. Its IUPAC name is 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
PubChem CID103494523
Molecular FormulaC16H23FN2
Molecular Weight262.37 g/mol
Exact Mass262.18
IUPAC Name2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
SMILESNCC(C1CCCCC1)N1CCc2ccc(F)cc21
InChIInChI=1S/C16H23FN2/c17-14-7-6-13-8-9-19(15(13)10-14)16(11-18)12-4-2-1-3-5-12/h6-7,10,12,16H,1-5,8-9,11,18H2
InChIKeyIWEOOXKJEZRKQH-UHFFFAOYSA-N
XLogP3.10
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2-(6-fluoro-2,3-dihydroindol-1-yl)propanoic acid
CID 103494512
1-cyclopentyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494909
2-(6-fluoro-2,3-dihydroindol-1-yl)-5-methylsulfanylpentan-1-amine
CID 103494475
2-(2,6-dichlorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494477
2-(3-chloro-5-fluorophenyl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494431
[1-(6-fluoro-2,3-dihydroindol-1-yl)-3-propan-2-ylcyclohexyl]methanamine
CID 107449256
2-(1,3-dimethylpyrazol-4-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494548
2-(3-bromofuran-2-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 106885883
2-(4,5-dibromofuran-2-yl)-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494492
(2-aminocycloheptyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103810197
3-(6-fluoro-2,3-dihydroindol-1-yl)-2-methylbutanoic acid
CID 103498081
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine
CID 103497070

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine?
The IUPAC name of 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine (CID 103494523) is 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine?
The canonical SMILES for 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine is NCC(C1CCCCC1)N1CCc2ccc(F)cc21.
What is the InChIKey of 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine?
The InChIKey is IWEOOXKJEZRKQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2/c17-14-7-6-13-8-9-19(15(13)10-14)16(11-18)12-4-2-1-3-5-12/h6-7,10,12,16H,1-5,8-9,11,18H2.
What are the key properties of 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine?
2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine has a molecular weight of 262.37 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine is sourced from PubChem (CID 103494523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).