6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine

C13H18FN — CID 10398118

IUPAC6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCCNC1CCc2cc(F)ccc2C1
InChIInChI=1S/C13H18FN/c1-2-7-15-13-6-4-10-8-12(14)5-3-11(10)9-13/h3,5,8,13,15H,2,4,6-7,9H2,1H3
InChIKeyFPJDYLPAAFVKBL-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.68
Rot. Bonds3

About 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine

6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 10398118) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID10398118
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCCNC1CCc2cc(F)ccc2C1
InChIInChI=1S/C13H18FN/c1-2-7-15-13-6-4-10-8-12(14)5-3-11(10)9-13/h3,5,8,13,15H,2,4,6-7,9H2,1H3
InChIKeyFPJDYLPAAFVKBL-UHFFFAOYSA-N
XLogP2.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
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 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 10398118) is 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine is CCCNC1CCc2cc(F)ccc2C1.
What is the InChIKey of 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is FPJDYLPAAFVKBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-2-7-15-13-6-4-10-8-12(14)5-3-11(10)9-13/h3,5,8,13,15H,2,4,6-7,9H2,1H3.
What are the key properties of 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine?
6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 207.29 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 10398118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).