5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine

C13H18FN — CID 115058068

IUPAC5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCC(C)C1c2cccc(F)c2CCC1N
InChIInChI=1S/C13H18FN/c1-8(2)13-10-4-3-5-11(14)9(10)6-7-12(13)15/h3-5,8,12-13H,6-7,15H2,1-2H3
InChIKeyQPCONVQSCUNNHJ-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.84
Rot. Bonds1

About 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine

5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 115058068) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID115058068
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCC(C)C1c2cccc(F)c2CCC1N
InChIInChI=1S/C13H18FN/c1-8(2)13-10-4-3-5-11(14)9(10)6-7-12(13)15/h3-5,8,12-13H,6-7,15H2,1-2H3
InChIKeyQPCONVQSCUNNHJ-UHFFFAOYSA-N
XLogP2.84
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 ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methoxy-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115058079
4-fluoro-2,3-dihydro-1H-inden-1-amine;methanamine
CID 175262813
1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)ethanamine
CID 83069908
2-(4-fluoro-2,3-dihydro-1H-inden-1-yl)propan-1-amine
CID 83907555
4-fluoro-2,3-dihydro-1H-indene-1-thiol
CID 83070034
4-fluoro-N-(2-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
CID 83065400
(2R)-2-amino-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)propanamide
CID 119302149
4-fluoro-N-[1-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-inden-1-amine
CID 78956060
4-fluoro-N-(3-methyl-2-propan-2-ylbutyl)-2,3-dihydro-1H-inden-1-amine
CID 102904112
N-[(1R)-1-cyclopentylethyl]-4-fluoro-2,3-dihydro-1H-inden-1-amine
CID 83065507
(2R)-2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]propan-1-ol
CID 114987002
1-(1-bromopropyl)-4-fluoro-2,3-dihydro-1H-indene
CID 83069594

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 115058068) is 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine is CC(C)C1c2cccc(F)c2CCC1N.
What is the InChIKey of 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is QPCONVQSCUNNHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-8(2)13-10-4-3-5-11(14)9(10)6-7-12(13)15/h3-5,8,12-13H,6-7,15H2,1-2H3.
What are the key properties of 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 207.29 g/mol, XLogP of 2.84, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 115058068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).