1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine

C13H12FN — CID 105453517

IUPAC1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine
SMILESNC1(c2cccc3ccc(F)cc23)CC1
InChIInChI=1S/C13H12FN/c14-10-5-4-9-2-1-3-12(11(9)8-10)13(15)6-7-13/h1-5,8H,6-7,15H2
InChIKeyWAJFSPKSSIEEJA-UHFFFAOYSA-N
MW201.24 g/mol
LogP2.93
Rot. Bonds1

About 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine

1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine (PubChem CID 105453517) has the molecular formula C13H12FN and a molecular weight of 201.24 g/mol. Its IUPAC name is 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine
PubChem CID105453517
Molecular FormulaC13H12FN
Molecular Weight201.24 g/mol
Exact Mass201.10
IUPAC Name1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine
SMILESNC1(c2cccc3ccc(F)cc23)CC1
InChIInChI=1S/C13H12FN/c14-10-5-4-9-2-1-3-12(11(9)8-10)13(15)6-7-13/h1-5,8H,6-7,15H2
InChIKeyWAJFSPKSSIEEJA-UHFFFAOYSA-N
XLogP2.93
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.24
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine?
The IUPAC name of 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine (CID 105453517) is 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine is NC1(c2cccc3ccc(F)cc23)CC1.
What is the InChIKey of 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine?
The InChIKey is WAJFSPKSSIEEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN/c14-10-5-4-9-2-1-3-12(11(9)8-10)13(15)6-7-13/h1-5,8H,6-7,15H2.
What are the key properties of 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine?
1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine has a molecular weight of 201.24 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoronaphthalen-1-yl)cyclopropan-1-amine is sourced from PubChem (CID 105453517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).