6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine

C12H16FNO — CID 80698721

IUPAC6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESNC1CCCc2cc(OCCF)ccc21
InChIInChI=1S/C12H16FNO/c13-6-7-15-10-4-5-11-9(8-10)2-1-3-12(11)14/h4-5,8,12H,1-3,6-7,14H2
InChIKeyBFKKCWHXQKMWPA-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.37
Rot. Bonds3

About 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine

6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 80698721) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID80698721
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESNC1CCCc2cc(OCCF)ccc21
InChIInChI=1S/C12H16FNO/c13-6-7-15-10-4-5-11-9(8-10)2-1-3-12(11)14/h4-5,8,12H,1-3,6-7,14H2
InChIKeyBFKKCWHXQKMWPA-UHFFFAOYSA-N
XLogP2.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(5-amino-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]propane-1,2-diol
CID 82850996
2-[(8-amino-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]ethanol
CID 103719192
ethane;(6-propoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 144986736
6-(5-fluoropentoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 114280270
(1S)-7-pent-3-ynoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 114091155
(1S)-5-ethoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 70817218
(1R)-7-(2,2,2-trifluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 114091185
6-(4-ethylcyclohexyl)oxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64748271
6-fluoro-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 71757709
5-(2-propylsulfonylethoxy)-2,3-dihydro-1H-inden-1-amine
CID 107683001
(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
CID 71416765
2-[[5-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]acetamide
CID 14181183

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine (CID 80698721) is 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine is NC1CCCc2cc(OCCF)ccc21.
What is the InChIKey of 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is BFKKCWHXQKMWPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-6-7-15-10-4-5-11-9(8-10)2-1-3-12(11)14/h4-5,8,12H,1-3,6-7,14H2.
What are the key properties of 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 209.26 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 80698721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).