(1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine

C20H20FN — CID 72708647

IUPAC(1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine
SMILESC[C@H](c1cccc2ccccc12)N(C)Cc1ccc(F)cc1
InChIInChI=1S/C20H20FN/c1-15(22(2)14-16-10-12-18(21)13-11-16)19-9-5-7-17-6-3-4-8-20(17)19/h3-13,15H,14H2,1-2H3/t15-/m1/s1
InChIKeyCULDGHNTMNPVQZ-OAHLLOKOSA-N
MW293.39 g/mol
LogP5.17
Rot. Bonds4

About (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine

(1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine (PubChem CID 72708647) has the molecular formula C20H20FN and a molecular weight of 293.39 g/mol. Its IUPAC name is (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine.

Molecular Properties

Compound Name(1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine
PubChem CID72708647
Molecular FormulaC20H20FN
Molecular Weight293.39 g/mol
Exact Mass293.16
IUPAC Name(1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine
SMILESC[C@H](c1cccc2ccccc12)N(C)Cc1ccc(F)cc1
InChIInChI=1S/C20H20FN/c1-15(22(2)14-16-10-12-18(21)13-11-16)19-9-5-7-17-6-3-4-8-20(17)19/h3-13,15H,14H2,1-2H3/t15-/m1/s1
InChIKeyCULDGHNTMNPVQZ-OAHLLOKOSA-N
XLogP5.17
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.39
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Terbinafine Hydrochloride
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Xaliproden
CID 128919
Butenafine Hydrochloride
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Naftifine Hydrochloride
CID 5281098
Xaliproden Hydrochloride
CID 128918
1-Benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline
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Dimethyldodecyl(1-naphthylmethyl)ammonium chloride
CID 61271

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine?
The IUPAC name of (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine (CID 72708647) is (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine.
What is the SMILES notation for (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine?
The canonical SMILES for (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine is C[C@H](c1cccc2ccccc12)N(C)Cc1ccc(F)cc1.
What is the InChIKey of (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine?
The InChIKey is CULDGHNTMNPVQZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H20FN/c1-15(22(2)14-16-10-12-18(21)13-11-16)19-9-5-7-17-6-3-4-8-20(17)19/h3-13,15H,14H2,1-2H3/t15-/m1/s1.
What are the key properties of (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine?
(1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine has a molecular weight of 293.39 g/mol, XLogP of 5.17, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[(4-fluorophenyl)methyl]-N-methyl-1-naphthalen-1-ylethanamine is sourced from PubChem (CID 72708647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).