1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol

C18H16FNO — CID 60720496

IUPAC1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol
SMILESOC(CNc1cccc2ccccc12)c1ccc(F)cc1
InChIInChI=1S/C18H16FNO/c19-15-10-8-14(9-11-15)18(21)12-20-17-7-3-5-13-4-1-2-6-16(13)17/h1-11,18,20-21H,12H2
InChIKeyXFXHSALVPRNWIP-UHFFFAOYSA-N
MW281.33 g/mol
LogP4.12
Rot. Bonds4

About 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol

1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol (PubChem CID 60720496) has the molecular formula C18H16FNO and a molecular weight of 281.33 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol
PubChem CID60720496
Molecular FormulaC18H16FNO
Molecular Weight281.33 g/mol
Exact Mass281.12
IUPAC Name1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol
SMILESOC(CNc1cccc2ccccc12)c1ccc(F)cc1
InChIInChI=1S/C18H16FNO/c19-15-10-8-14(9-11-15)18(21)12-20-17-7-3-5-13-4-1-2-6-16(13)17/h1-11,18,20-21H,12H2
InChIKeyXFXHSALVPRNWIP-UHFFFAOYSA-N
XLogP4.12
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol (CID 60720496) is 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol is OC(CNc1cccc2ccccc12)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol?
The InChIKey is XFXHSALVPRNWIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FNO/c19-15-10-8-14(9-11-15)18(21)12-20-17-7-3-5-13-4-1-2-6-16(13)17/h1-11,18,20-21H,12H2.
What are the key properties of 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol?
1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol has a molecular weight of 281.33 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-(naphthalen-1-ylamino)ethanol is sourced from PubChem (CID 60720496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).