2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide

C15H13FINO — CID 55083380

IUPAC2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide
SMILESCc1ccc(F)c(C(=O)Nc2ccc(I)cc2C)c1
InChIInChI=1S/C15H13FINO/c1-9-3-5-13(16)12(7-9)15(19)18-14-6-4-11(17)8-10(14)2/h3-8H,1-2H3,(H,18,19)
InChIKeySKGREJYQMFHQKM-UHFFFAOYSA-N
MW369.18 g/mol
LogP4.30
Rot. Bonds2

About 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide

2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide (PubChem CID 55083380) has the molecular formula C15H13FINO and a molecular weight of 369.18 g/mol. Its IUPAC name is 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide.

Molecular Properties

Compound Name2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide
PubChem CID55083380
Molecular FormulaC15H13FINO
Molecular Weight369.18 g/mol
Exact Mass369.00
IUPAC Name2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide
SMILESCc1ccc(F)c(C(=O)Nc2ccc(I)cc2C)c1
InChIInChI=1S/C15H13FINO/c1-9-3-5-13(16)12(7-9)15(19)18-14-6-4-11(17)8-10(14)2/h3-8H,1-2H3,(H,18,19)
InChIKeySKGREJYQMFHQKM-UHFFFAOYSA-N
XLogP4.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.18
LogP ≤ 54.30
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

N-(2,4-dimethylphenyl)-2-fluoro-5-sulfanylbenzamide
CID 107020951
2-[(2-fluoro-5-methylbenzoyl)amino]-5-methylbenzoic acid
CID 62515827
4-fluoro-N-(4-iodo-2-methylphenyl)-3-methylbenzamide
CID 63213134
N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide
CID 55083427
N-(2,4-dimethylphenyl)-2-fluorobenzamide
CID 579639
N-(2,4-dimethylphenyl)acetamide;N-(4-iodo-2-methylphenyl)acetamide
CID 90975910
N-(4-amino-2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62515470
2-[(2-fluoro-5-methylbenzoyl)amino]-5-hydroxybenzoic acid
CID 62514253
2-hydroxy-5-iodo-N-(4-iodo-2-methylphenyl)benzamide
CID 86251688
2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide
CID 62509266
3-[(2-fluoro-5-methylbenzoyl)amino]-4-methylbenzoic acid
CID 62514248
2-fluoro-N-(3-hydroxy-2-methylphenyl)-5-methylbenzamide
CID 64794363

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide?
The IUPAC name of 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide (CID 55083380) is 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide.
What is the SMILES notation for 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide?
The canonical SMILES for 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide is Cc1ccc(F)c(C(=O)Nc2ccc(I)cc2C)c1.
What is the InChIKey of 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide?
The InChIKey is SKGREJYQMFHQKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FINO/c1-9-3-5-13(16)12(7-9)15(19)18-14-6-4-11(17)8-10(14)2/h3-8H,1-2H3,(H,18,19).
What are the key properties of 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide?
2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide has a molecular weight of 369.18 g/mol, XLogP of 4.30, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(4-iodo-2-methylphenyl)-5-methylbenzamide is sourced from PubChem (CID 55083380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).