(2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine

C13H18FN — CID 10608413

IUPAC(2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCC(C)N[C@@H]1CCc2c(F)cccc2C1
InChIInChI=1S/C13H18FN/c1-9(2)15-11-6-7-12-10(8-11)4-3-5-13(12)14/h3-5,9,11,15H,6-8H2,1-2H3/t11-/m1/s1
InChIKeyPEALWHNJZNZNMZ-LLVKDONJSA-N
MW207.29 g/mol
LogP2.68
Rot. Bonds2

About (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine

(2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 10608413) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name(2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID10608413
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name(2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCC(C)N[C@@H]1CCc2c(F)cccc2C1
InChIInChI=1S/C13H18FN/c1-9(2)15-11-6-7-12-10(8-11)4-3-5-13(12)14/h3-5,9,11,15H,6-8H2,1-2H3/t11-/m1/s1
InChIKeyPEALWHNJZNZNMZ-LLVKDONJSA-N
XLogP2.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 10608413) is (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine is CC(C)N[C@@H]1CCc2c(F)cccc2C1.
What is the InChIKey of (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is PEALWHNJZNZNMZ-LLVKDONJSA-N. The full InChI is InChI=1S/C13H18FN/c1-9(2)15-11-6-7-12-10(8-11)4-3-5-13(12)14/h3-5,9,11,15H,6-8H2,1-2H3/t11-/m1/s1.
What are the key properties of (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
(2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 207.29 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-fluoro-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 10608413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).