N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide

C13H9ClFNO2 — CID 168652553

IUPACN-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide
SMILESO=CNc1cc(Cl)ccc1Oc1cccc(F)c1
InChIInChI=1S/C13H9ClFNO2/c14-9-4-5-13(12(6-9)16-8-17)18-11-3-1-2-10(15)7-11/h1-8H,(H,16,17)
InChIKeyWVLUAZFFPWCAOA-UHFFFAOYSA-N
MW265.67 g/mol
LogP3.84
Rot. Bonds4

About N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide

N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide (PubChem CID 168652553) has the molecular formula C13H9ClFNO2 and a molecular weight of 265.67 g/mol. Its IUPAC name is N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide.

Molecular Properties

Compound NameN-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide
PubChem CID168652553
Molecular FormulaC13H9ClFNO2
Molecular Weight265.67 g/mol
Exact Mass265.03
IUPAC NameN-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide
SMILESO=CNc1cc(Cl)ccc1Oc1cccc(F)c1
InChIInChI=1S/C13H9ClFNO2/c14-9-4-5-13(12(6-9)16-8-17)18-11-3-1-2-10(15)7-11/h1-8H,(H,16,17)
InChIKeyWVLUAZFFPWCAOA-UHFFFAOYSA-N
XLogP3.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.67
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-[[5-chloro-2-(3-fluorophenoxy)anilino]methylidene]propanedinitrile
CID 168544169
4-chloro-2-(3-fluorophenoxy)benzaldehyde
CID 58753975
N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide
CID 88886136
5-fluoro-2-(3-fluorophenoxy)benzaldehyde
CID 43313270
N-[2-(4-fluorophenoxy)phenyl]formamide
CID 86192955
N-(5-methyl-2-phenoxyphenyl)formamide
CID 2336214
4-chloro-2-(3-fluorophenoxy)-N'-hydroxybenzenecarboximidamide
CID 55182535
N-[[4-chloro-2-(3-fluorophenoxy)phenyl]methyl]propan-2-amine
CID 114855809
N-[[3-chloro-4-(3-fluorophenoxy)phenyl]methyl]ethanamine
CID 81154570
7-chloro-4-(3-fluorophenoxy)quinoline
CID 19879037
4-[1-[[5-chloro-2-(3-fluorophenoxy)benzoyl]amino]ethyl]benzoic acid
CID 73016543
N-(5-chloro-2-methoxyphenyl)-2-(3-fluorophenoxy)acetamide
CID 2710232

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide?
The IUPAC name of N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide (CID 168652553) is N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide.
What is the SMILES notation for N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide?
The canonical SMILES for N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide is O=CNc1cc(Cl)ccc1Oc1cccc(F)c1.
What is the InChIKey of N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide?
The InChIKey is WVLUAZFFPWCAOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClFNO2/c14-9-4-5-13(12(6-9)16-8-17)18-11-3-1-2-10(15)7-11/h1-8H,(H,16,17).
What are the key properties of N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide?
N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide has a molecular weight of 265.67 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide is sourced from PubChem (CID 168652553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).