N-(difluoromethoxy)dibenzofuran-1-carboxamide

C14H9F2NO3 — CID 154511736

IUPACN-(difluoromethoxy)dibenzofuran-1-carboxamide
SMILESO=C(NOC(F)F)c1cccc2oc3ccccc3c12
InChIInChI=1S/C14H9F2NO3/c15-14(16)20-17-13(18)9-5-3-7-11-12(9)8-4-1-2-6-10(8)19-11/h1-7,14H,(H,17,18)
InChIKeyPFVAMLMVJCWNNR-UHFFFAOYSA-N
MW277.23 g/mol
LogP3.47
Rot. Bonds3

About N-(difluoromethoxy)dibenzofuran-1-carboxamide

N-(difluoromethoxy)dibenzofuran-1-carboxamide (PubChem CID 154511736) has the molecular formula C14H9F2NO3 and a molecular weight of 277.23 g/mol. Its IUPAC name is N-(difluoromethoxy)dibenzofuran-1-carboxamide.

Molecular Properties

Compound NameN-(difluoromethoxy)dibenzofuran-1-carboxamide
PubChem CID154511736
Molecular FormulaC14H9F2NO3
Molecular Weight277.23 g/mol
Exact Mass277.06
IUPAC NameN-(difluoromethoxy)dibenzofuran-1-carboxamide
SMILESO=C(NOC(F)F)c1cccc2oc3ccccc3c12
InChIInChI=1S/C14H9F2NO3/c15-14(16)20-17-13(18)9-5-3-7-11-12(9)8-4-1-2-6-10(8)19-11/h1-7,14H,(H,17,18)
InChIKeyPFVAMLMVJCWNNR-UHFFFAOYSA-N
XLogP3.47
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.23
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(difluoromethoxy)dibenzofuran-1-carboxamide?
The IUPAC name of N-(difluoromethoxy)dibenzofuran-1-carboxamide (CID 154511736) is N-(difluoromethoxy)dibenzofuran-1-carboxamide.
What is the SMILES notation for N-(difluoromethoxy)dibenzofuran-1-carboxamide?
The canonical SMILES for N-(difluoromethoxy)dibenzofuran-1-carboxamide is O=C(NOC(F)F)c1cccc2oc3ccccc3c12.
What is the InChIKey of N-(difluoromethoxy)dibenzofuran-1-carboxamide?
The InChIKey is PFVAMLMVJCWNNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2NO3/c15-14(16)20-17-13(18)9-5-3-7-11-12(9)8-4-1-2-6-10(8)19-11/h1-7,14H,(H,17,18).
What are the key properties of N-(difluoromethoxy)dibenzofuran-1-carboxamide?
N-(difluoromethoxy)dibenzofuran-1-carboxamide has a molecular weight of 277.23 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(difluoromethoxy)dibenzofuran-1-carboxamide is sourced from PubChem (CID 154511736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).