2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine

C18H20FN — CID 65404575

IUPAC2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
SMILESNC(Cc1cccc(F)c1)C1CCc2ccccc2C1
InChIInChI=1S/C18H20FN/c19-17-7-3-4-13(10-17)11-18(20)16-9-8-14-5-1-2-6-15(14)12-16/h1-7,10,16,18H,8-9,11-12,20H2
InChIKeyBXRPTLUBZWEUEN-UHFFFAOYSA-N
MW269.36 g/mol
LogP3.50
Rot. Bonds3

About 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine

2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine (PubChem CID 65404575) has the molecular formula C18H20FN and a molecular weight of 269.36 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
PubChem CID65404575
Molecular FormulaC18H20FN
Molecular Weight269.36 g/mol
Exact Mass269.16
IUPAC Name2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
SMILESNC(Cc1cccc(F)c1)C1CCc2ccccc2C1
InChIInChI=1S/C18H20FN/c19-17-7-3-4-13(10-17)11-18(20)16-9-8-14-5-1-2-6-15(14)12-16/h1-7,10,16,18H,8-9,11-12,20H2
InChIKeyBXRPTLUBZWEUEN-UHFFFAOYSA-N
XLogP3.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.36
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404384
2-(2-chloro-4-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65403993
2-(4-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404581
2-(2-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404776
2-pyridin-3-yl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 104736415
2-(5-bromo-3-pyridinyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 104802640
1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
CID 91218484
2-(3-bromo-4-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanamine
CID 65412077
2-(2,5-dimethylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65405157
2-(4-fluoro-2-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanol
CID 114347478
[2-(3-chlorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethyl]hydrazine
CID 105234719
2-(3-fluorophenyl)-1-(2,2,3,3-tetramethylcyclopropyl)ethanamine
CID 66475957

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The IUPAC name of 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine (CID 65404575) is 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine.
What is the SMILES notation for 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The canonical SMILES for 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine is NC(Cc1cccc(F)c1)C1CCc2ccccc2C1.
What is the InChIKey of 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
The InChIKey is BXRPTLUBZWEUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN/c19-17-7-3-4-13(10-17)11-18(20)16-9-8-14-5-1-2-6-15(14)12-16/h1-7,10,16,18H,8-9,11-12,20H2.
What are the key properties of 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine?
2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine has a molecular weight of 269.36 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine is sourced from PubChem (CID 65404575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).