2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine

C15H21FN2 — CID 103497070

IUPAC2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine
SMILESNC1CCCCC1CN1CCc2ccc(F)cc21
InChIInChI=1S/C15H21FN2/c16-13-6-5-11-7-8-18(15(11)9-13)10-12-3-1-2-4-14(12)17/h5-6,9,12,14H,1-4,7-8,10,17H2
InChIKeyKLGKOZIPYKQHKA-UHFFFAOYSA-N
MW248.34 g/mol
LogP2.71
Rot. Bonds2

About 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine

2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine (PubChem CID 103497070) has the molecular formula C15H21FN2 and a molecular weight of 248.34 g/mol. Its IUPAC name is 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine
PubChem CID103497070
Molecular FormulaC15H21FN2
Molecular Weight248.34 g/mol
Exact Mass248.17
IUPAC Name2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine
SMILESNC1CCCCC1CN1CCc2ccc(F)cc21
InChIInChI=1S/C15H21FN2/c16-13-6-5-11-7-8-18(15(11)9-13)10-12-3-1-2-4-14(12)17/h5-6,9,12,14H,1-4,7-8,10,17H2
InChIKeyKLGKOZIPYKQHKA-UHFFFAOYSA-N
XLogP2.71
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.34
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 103502585
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine
CID 103502594
1-cyclopentyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494909
(2-aminocycloheptyl)-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103810197
(E)-4-(6-fluoro-2,3-dihydroindol-1-yl)but-2-en-1-amine
CID 103495908
4-(6-fluoro-2,3-dihydroindol-1-yl)butane-1-thiol
CID 103504365
2-cyclohexyl-2-(6-fluoro-2,3-dihydroindol-1-yl)ethanamine
CID 103494523
methyl 3-(6-fluoro-2,3-dihydroindol-1-yl)-2-methylpropanoate
CID 103497970
4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine
CID 103497186
[2-(aminomethyl)cyclopentyl]-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103822177
4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]thiadiazol-5-amine
CID 103502277
4-(6-fluoro-2,3-dihydroindol-1-yl)-2,2-dimethylbutanethioamide
CID 103495730

Frequently Asked Questions

What is the IUPAC name of 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine (CID 103497070) is 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine is NC1CCCCC1CN1CCc2ccc(F)cc21.
What is the InChIKey of 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine?
The InChIKey is KLGKOZIPYKQHKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2/c16-13-6-5-11-7-8-18(15(11)9-13)10-12-3-1-2-4-14(12)17/h5-6,9,12,14H,1-4,7-8,10,17H2.
What are the key properties of 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine?
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine has a molecular weight of 248.34 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 103497070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).