N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide

C18H13ClFNO2 — CID 26309229

IUPACN-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1cccc(Cl)c1F
InChIInChI=1S/C18H13ClFNO2/c19-15-6-3-7-16(18(15)20)21-17(22)11-23-14-9-8-12-4-1-2-5-13(12)10-14/h1-10H,11H2,(H,21,22)
InChIKeyPHHIFFGSOPNSDL-UHFFFAOYSA-N
MW329.76 g/mol
LogP4.65
Rot. Bonds4

About N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide

N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide (PubChem CID 26309229) has the molecular formula C18H13ClFNO2 and a molecular weight of 329.76 g/mol. Its IUPAC name is N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide
PubChem CID26309229
Molecular FormulaC18H13ClFNO2
Molecular Weight329.76 g/mol
Exact Mass329.06
IUPAC NameN-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1cccc(Cl)c1F
InChIInChI=1S/C18H13ClFNO2/c19-15-6-3-7-16(18(15)20)21-17(22)11-23-14-9-8-12-4-1-2-5-13(12)10-14/h1-10H,11H2,(H,21,22)
InChIKeyPHHIFFGSOPNSDL-UHFFFAOYSA-N
XLogP4.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.76
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide (CID 26309229) is N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide is O=C(COc1ccc2ccccc2c1)Nc1cccc(Cl)c1F.
What is the InChIKey of N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide?
The InChIKey is PHHIFFGSOPNSDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClFNO2/c19-15-6-3-7-16(18(15)20)21-17(22)11-23-14-9-8-12-4-1-2-5-13(12)10-14/h1-10H,11H2,(H,21,22).
What are the key properties of N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide?
N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide has a molecular weight of 329.76 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 26309229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).