6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine

C16H17FN2 — CID 115756197

IUPAC6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine
SMILESCC1CCC(Nc2cccc(F)n2)c2ccccc21
InChIInChI=1S/C16H17FN2/c1-11-9-10-14(13-6-3-2-5-12(11)13)18-16-8-4-7-15(17)19-16/h2-8,11,14H,9-10H2,1H3,(H,18,19)
InChIKeyGCWSLYNNIUVPEA-UHFFFAOYSA-N
MW256.32 g/mol
LogP4.27
Rot. Bonds2

About 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine

6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine (PubChem CID 115756197) has the molecular formula C16H17FN2 and a molecular weight of 256.32 g/mol. Its IUPAC name is 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine.

Molecular Properties

Compound Name6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine
PubChem CID115756197
Molecular FormulaC16H17FN2
Molecular Weight256.32 g/mol
Exact Mass256.14
IUPAC Name6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine
SMILESCC1CCC(Nc2cccc(F)n2)c2ccccc21
InChIInChI=1S/C16H17FN2/c1-11-9-10-14(13-6-3-2-5-12(11)13)18-16-8-4-7-15(17)19-16/h2-8,11,14H,9-10H2,1H3,(H,18,19)
InChIKeyGCWSLYNNIUVPEA-UHFFFAOYSA-N
XLogP4.27
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine?
The IUPAC name of 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine (CID 115756197) is 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine.
What is the SMILES notation for 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine?
The canonical SMILES for 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine is CC1CCC(Nc2cccc(F)n2)c2ccccc21.
What is the InChIKey of 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine?
The InChIKey is GCWSLYNNIUVPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2/c1-11-9-10-14(13-6-3-2-5-12(11)13)18-16-8-4-7-15(17)19-16/h2-8,11,14H,9-10H2,1H3,(H,18,19).
What are the key properties of 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine?
6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine has a molecular weight of 256.32 g/mol, XLogP of 4.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridin-2-amine is sourced from PubChem (CID 115756197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).