4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide

C25H18F2N2O3 — CID 1363649

IUPAC4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide
SMILESO=C(Nc1ccc(C(=O)Nc2cccc3ccccc23)cc1)c1ccc(OC(F)F)cc1
InChIInChI=1S/C25H18F2N2O3/c26-25(27)32-20-14-10-18(11-15-20)23(30)28-19-12-8-17(9-13-19)24(31)29-22-7-3-5-16-4-1-2-6-21(16)22/h1-15,25H,(H,28,30)(H,29,31)
InChIKeyYNVDDEODJKKLBP-UHFFFAOYSA-N
MW432.43 g/mol
LogP5.95
Rot. Bonds6

About 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide

4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide (PubChem CID 1363649) has the molecular formula C25H18F2N2O3 and a molecular weight of 432.43 g/mol. Its IUPAC name is 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide.

Molecular Properties

Compound Name4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide
PubChem CID1363649
Molecular FormulaC25H18F2N2O3
Molecular Weight432.43 g/mol
Exact Mass432.13
IUPAC Name4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide
SMILESO=C(Nc1ccc(C(=O)Nc2cccc3ccccc23)cc1)c1ccc(OC(F)F)cc1
InChIInChI=1S/C25H18F2N2O3/c26-25(27)32-20-14-10-18(11-15-20)23(30)28-19-12-8-17(9-13-19)24(31)29-22-7-3-5-16-4-1-2-6-21(16)22/h1-15,25H,(H,28,30)(H,29,31)
InChIKeyYNVDDEODJKKLBP-UHFFFAOYSA-N
XLogP5.95
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.43
LogP ≤ 55.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(difluoromethoxy)-N-naphthalen-2-ylbenzamide
CID 2666065
4-[(4-bromobenzoyl)amino]-N-naphthalen-1-ylbenzamide
CID 1215843
N-(4-acetamidophenyl)-4-(difluoromethoxy)benzamide
CID 2168312
4-[[4-(difluoromethoxy)benzoyl]amino]benzamide
CID 842852
4-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]benzamide
CID 26027108
ethyl 4-[[4-(difluoromethoxy)benzoyl]amino]benzoate
CID 2677138
2-[[4-(difluoromethoxy)benzoyl]amino]-N-ethylbenzamide
CID 35302926
N-naphthalen-1-yl-4-sulfanylbenzamide
CID 107019782
N-[4-(difluoromethoxy)phenyl]-2-iodobenzamide
CID 7941252
N-[4-(difluoromethoxy)phenyl]-1-oxidopyridin-1-ium-4-carboxamide
CID 2390885
4-heptoxy-N-naphthalen-1-ylbenzamide
CID 4950571
butyl 4-[[4-(difluoromethoxy)benzoyl]amino]benzoate
CID 7926949

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide?
The IUPAC name of 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide (CID 1363649) is 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide.
What is the SMILES notation for 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide?
The canonical SMILES for 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide is O=C(Nc1ccc(C(=O)Nc2cccc3ccccc23)cc1)c1ccc(OC(F)F)cc1.
What is the InChIKey of 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide?
The InChIKey is YNVDDEODJKKLBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18F2N2O3/c26-25(27)32-20-14-10-18(11-15-20)23(30)28-19-12-8-17(9-13-19)24(31)29-22-7-3-5-16-4-1-2-6-21(16)22/h1-15,25H,(H,28,30)(H,29,31).
What are the key properties of 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide?
4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide has a molecular weight of 432.43 g/mol, XLogP of 5.95, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(difluoromethoxy)benzoyl]amino]-N-naphthalen-1-ylbenzamide is sourced from PubChem (CID 1363649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).