N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide

C14H9ClF2INO — CID 103766816

IUPACN-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1F)Nc1ccc(Cl)cc1I
InChIInChI=1S/C14H9ClF2INO/c15-9-2-4-13(12(18)6-9)19-14(20)5-8-1-3-10(16)7-11(8)17/h1-4,6-7H,5H2,(H,19,20)
InChIKeyPJSZPDOYJRNFJS-UHFFFAOYSA-N
MW407.59 g/mol
LogP4.40
Rot. Bonds3

About N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide

N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide (PubChem CID 103766816) has the molecular formula C14H9ClF2INO and a molecular weight of 407.59 g/mol. Its IUPAC name is N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide
PubChem CID103766816
Molecular FormulaC14H9ClF2INO
Molecular Weight407.59 g/mol
Exact Mass406.94
IUPAC NameN-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1F)Nc1ccc(Cl)cc1I
InChIInChI=1S/C14H9ClF2INO/c15-9-2-4-13(12(18)6-9)19-14(20)5-8-1-3-10(16)7-11(8)17/h1-4,6-7H,5H2,(H,19,20)
InChIKeyPJSZPDOYJRNFJS-UHFFFAOYSA-N
XLogP4.40
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.59
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-N-(4-chloro-2-iodophenyl)acetamide
CID 107624932
N-(2-amino-4-hydroxyphenyl)-2-(2,4-difluorophenyl)acetamide
CID 107697659
N-(4-bromo-2,5-difluorophenyl)-2-(2,4-difluorophenyl)acetamide
CID 103842501
2-amino-N-(4-chloro-2-iodophenyl)-5-fluorobenzamide
CID 107624102
N-(4-chloro-2-fluorophenyl)-2-(4-fluorophenyl)acetamide
CID 7961331
2-(4-bromophenyl)-N-(4-fluoro-2-iodophenyl)acetamide
CID 79765971
N-(4-fluoro-2-iodophenyl)-2-sulfanylacetamide
CID 79771427
4-chloro-N-(4-fluoro-2-iodophenyl)-2-hydroxybenzamide
CID 79766720
2-(4-carbamothioylphenyl)-N-(4-chloro-2-iodophenyl)acetamide
CID 107626033
1-(4-chlorophenyl)-3-(4-fluoro-2-iodophenyl)urea
CID 79766072
5-(4-chloro-2-iodoanilino)-5-oxopentanoic acid
CID 104573932
N-(4-chloro-2-iodophenyl)-4-methylpentanamide
CID 103766832

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide?
The IUPAC name of N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide (CID 103766816) is N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide?
The canonical SMILES for N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide is O=C(Cc1ccc(F)cc1F)Nc1ccc(Cl)cc1I.
What is the InChIKey of N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide?
The InChIKey is PJSZPDOYJRNFJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF2INO/c15-9-2-4-13(12(18)6-9)19-14(20)5-8-1-3-10(16)7-11(8)17/h1-4,6-7H,5H2,(H,19,20).
What are the key properties of N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide?
N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide has a molecular weight of 407.59 g/mol, XLogP of 4.40, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-iodophenyl)-2-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 103766816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).