1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine

C18H16FN — CID 61032587

IUPAC1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine
SMILESCNCc1ccc(F)c(-c2ccc3ccccc3c2)c1
InChIInChI=1S/C18H16FN/c1-20-12-13-6-9-18(19)17(10-13)16-8-7-14-4-2-3-5-15(14)11-16/h2-11,20H,12H2,1H3
InChIKeyMQHPTJKYBZYCFN-UHFFFAOYSA-N
MW265.33 g/mol
LogP4.37
Rot. Bonds3

About 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine

1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine (PubChem CID 61032587) has the molecular formula C18H16FN and a molecular weight of 265.33 g/mol. Its IUPAC name is 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine
PubChem CID61032587
Molecular FormulaC18H16FN
Molecular Weight265.33 g/mol
Exact Mass265.13
IUPAC Name1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine
SMILESCNCc1ccc(F)c(-c2ccc3ccccc3c2)c1
InChIInChI=1S/C18H16FN/c1-20-12-13-6-9-18(19)17(10-13)16-8-7-14-4-2-3-5-15(14)11-16/h2-11,20H,12H2,1H3
InChIKeyMQHPTJKYBZYCFN-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine (CID 61032587) is 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine is CNCc1ccc(F)c(-c2ccc3ccccc3c2)c1.
What is the InChIKey of 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine?
The InChIKey is MQHPTJKYBZYCFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN/c1-20-12-13-6-9-18(19)17(10-13)16-8-7-14-4-2-3-5-15(14)11-16/h2-11,20H,12H2,1H3.
What are the key properties of 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine?
1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine has a molecular weight of 265.33 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-3-naphthalen-2-ylphenyl)-N-methylmethanamine is sourced from PubChem (CID 61032587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).