2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine

C13H18FN — CID 117296662

IUPAC2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine
SMILESCC(C)(N)c1cc2c(cc1F)CCCC2
InChIInChI=1S/C13H18FN/c1-13(2,15)11-7-9-5-3-4-6-10(9)8-12(11)14/h7-8H,3-6,15H2,1-2H3
InChIKeyKTWLDFMGYILWFH-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.90
Rot. Bonds1

About 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine

2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine (PubChem CID 117296662) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine.

Molecular Properties

Compound Name2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine
PubChem CID117296662
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine
SMILESCC(C)(N)c1cc2c(cc1F)CCCC2
InChIInChI=1S/C13H18FN/c1-13(2,15)11-7-9-5-3-4-6-10(9)8-12(11)14/h7-8H,3-6,15H2,1-2H3
InChIKeyKTWLDFMGYILWFH-UHFFFAOYSA-N
XLogP2.90
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-yl)propan-2-amine
CID 117339402
2-(6-fluoro-2,3-dihydro-1H-inden-5-yl)-2-methylpropan-1-ol
CID 117297811
2-(2-methyl-5,6,7,8-tetrahydroquinolin-3-yl)propan-2-amine
CID 82452293
2-(2-fluoro-4,5-dimethylphenyl)propan-2-amine
CID 84768561
2-(6-fluoro-4H-1,3-benzodioxin-7-yl)propan-2-amine
CID 117301446
3-(2-aminopropan-2-yl)-1-chloro-5,6,7,8-tetrahydronaphthalen-2-ol
CID 117352189
6-tert-butyl-7-fluoro-1,2,3,4-tetrahydroisoquinoline
CID 130473606
2-(2-fluoro-5-methoxy-4-methylphenyl)propan-2-amine
CID 84774491
1-(3-fluoro-4-pyridinyl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 104737775
2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 117283969
2-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-amine
CID 140896380
3-(2-hydroxypropan-2-yl)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 84674417

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine?
The IUPAC name of 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine (CID 117296662) is 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine.
What is the SMILES notation for 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine?
The canonical SMILES for 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine is CC(C)(N)c1cc2c(cc1F)CCCC2.
What is the InChIKey of 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine?
The InChIKey is KTWLDFMGYILWFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-13(2,15)11-7-9-5-3-4-6-10(9)8-12(11)14/h7-8H,3-6,15H2,1-2H3.
What are the key properties of 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine?
2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine has a molecular weight of 207.29 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-amine is sourced from PubChem (CID 117296662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).