2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide

C19H14F3NO3 — CID 94848502

IUPAC2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide
SMILESO=C(COc1cccc2ccccc12)Nc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C19H14F3NO3/c20-19(21,22)26-15-10-8-14(9-11-15)23-18(24)12-25-17-7-3-5-13-4-1-2-6-16(13)17/h1-11H,12H2,(H,23,24)
InChIKeyFNRYIRHBDYTNEI-UHFFFAOYSA-N
MW361.32 g/mol
LogP4.76
Rot. Bonds5

About 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide

2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide (PubChem CID 94848502) has the molecular formula C19H14F3NO3 and a molecular weight of 361.32 g/mol. Its IUPAC name is 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide
PubChem CID94848502
Molecular FormulaC19H14F3NO3
Molecular Weight361.32 g/mol
Exact Mass361.09
IUPAC Name2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide
SMILESO=C(COc1cccc2ccccc12)Nc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C19H14F3NO3/c20-19(21,22)26-15-10-8-14(9-11-15)23-18(24)12-25-17-7-3-5-13-4-1-2-6-16(13)17/h1-11H,12H2,(H,23,24)
InChIKeyFNRYIRHBDYTNEI-UHFFFAOYSA-N
XLogP4.76
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.32
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide (CID 94848502) is 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide is O=C(COc1cccc2ccccc12)Nc1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide?
The InChIKey is FNRYIRHBDYTNEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3NO3/c20-19(21,22)26-15-10-8-14(9-11-15)23-18(24)12-25-17-7-3-5-13-4-1-2-6-16(13)17/h1-11H,12H2,(H,23,24).
What are the key properties of 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide?
2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide has a molecular weight of 361.32 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 94848502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).