2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide

C19H15BrFNO2 — CID 1301597

IUPAC2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1Br)NCc1ccc(F)cc1
InChIInChI=1S/C19H15BrFNO2/c20-19-16-4-2-1-3-14(16)7-10-17(19)24-12-18(23)22-11-13-5-8-15(21)9-6-13/h1-10H,11-12H2,(H,22,23)
InChIKeyDLKPLSNOJFKBBZ-UHFFFAOYSA-N
MW388.24 g/mol
LogP4.44
Rot. Bonds5

About 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide

2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide (PubChem CID 1301597) has the molecular formula C19H15BrFNO2 and a molecular weight of 388.24 g/mol. Its IUPAC name is 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide
PubChem CID1301597
Molecular FormulaC19H15BrFNO2
Molecular Weight388.24 g/mol
Exact Mass387.03
IUPAC Name2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1Br)NCc1ccc(F)cc1
InChIInChI=1S/C19H15BrFNO2/c20-19-16-4-2-1-3-14(16)7-10-17(19)24-12-18(23)22-11-13-5-8-15(21)9-6-13/h1-10H,11-12H2,(H,22,23)
InChIKeyDLKPLSNOJFKBBZ-UHFFFAOYSA-N
XLogP4.44
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.24
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide?
The IUPAC name of 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide (CID 1301597) is 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide.
What is the SMILES notation for 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide?
The canonical SMILES for 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide is O=C(COc1ccc2ccccc2c1Br)NCc1ccc(F)cc1.
What is the InChIKey of 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide?
The InChIKey is DLKPLSNOJFKBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrFNO2/c20-19-16-4-2-1-3-14(16)7-10-17(19)24-12-18(23)22-11-13-5-8-15(21)9-6-13/h1-10H,11-12H2,(H,22,23).
What are the key properties of 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide?
2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide has a molecular weight of 388.24 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-bromonaphthalen-2-yl)oxy-N-[(4-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 1301597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).