N-(4-fluoro-2-iodo-3-methylphenyl)formamide

C8H7FINO — CID 168653017

IUPACN-(4-fluoro-2-iodo-3-methylphenyl)formamide
SMILESCc1c(F)ccc(NC=O)c1I
InChIInChI=1S/C8H7FINO/c1-5-6(9)2-3-7(8(5)10)11-4-12/h2-4H,1H3,(H,11,12)
InChIKeyZXWDGDOACRMKLD-UHFFFAOYSA-N
MW279.05 g/mol
LogP2.31
Rot. Bonds2

About N-(4-fluoro-2-iodo-3-methylphenyl)formamide

N-(4-fluoro-2-iodo-3-methylphenyl)formamide (PubChem CID 168653017) has the molecular formula C8H7FINO and a molecular weight of 279.05 g/mol. Its IUPAC name is N-(4-fluoro-2-iodo-3-methylphenyl)formamide.

Molecular Properties

Compound NameN-(4-fluoro-2-iodo-3-methylphenyl)formamide
PubChem CID168653017
Molecular FormulaC8H7FINO
Molecular Weight279.05 g/mol
Exact Mass278.96
IUPAC NameN-(4-fluoro-2-iodo-3-methylphenyl)formamide
SMILESCc1c(F)ccc(NC=O)c1I
InChIInChI=1S/C8H7FINO/c1-5-6(9)2-3-7(8(5)10)11-4-12/h2-4H,1H3,(H,11,12)
InChIKeyZXWDGDOACRMKLD-UHFFFAOYSA-N
XLogP2.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.05
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-iodo-3-methylphenyl)formamide?
The IUPAC name of N-(4-fluoro-2-iodo-3-methylphenyl)formamide (CID 168653017) is N-(4-fluoro-2-iodo-3-methylphenyl)formamide.
What is the SMILES notation for N-(4-fluoro-2-iodo-3-methylphenyl)formamide?
The canonical SMILES for N-(4-fluoro-2-iodo-3-methylphenyl)formamide is Cc1c(F)ccc(NC=O)c1I.
What is the InChIKey of N-(4-fluoro-2-iodo-3-methylphenyl)formamide?
The InChIKey is ZXWDGDOACRMKLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FINO/c1-5-6(9)2-3-7(8(5)10)11-4-12/h2-4H,1H3,(H,11,12).
What are the key properties of N-(4-fluoro-2-iodo-3-methylphenyl)formamide?
N-(4-fluoro-2-iodo-3-methylphenyl)formamide has a molecular weight of 279.05 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-iodo-3-methylphenyl)formamide is sourced from PubChem (CID 168653017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).