N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide

C14H11FINO2 — CID 104628285

IUPACN-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide
SMILESCc1cc(NC(=O)c2ccc(I)c(O)c2)ccc1F
InChIInChI=1S/C14H11FINO2/c1-8-6-10(3-4-11(8)15)17-14(19)9-2-5-12(16)13(18)7-9/h2-7,18H,1H3,(H,17,19)
InChIKeyWUIFHKFAYOPTBW-UHFFFAOYSA-N
MW371.15 g/mol
LogP3.70
Rot. Bonds2

About N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide

N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide (PubChem CID 104628285) has the molecular formula C14H11FINO2 and a molecular weight of 371.15 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide
PubChem CID104628285
Molecular FormulaC14H11FINO2
Molecular Weight371.15 g/mol
Exact Mass370.98
IUPAC NameN-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide
SMILESCc1cc(NC(=O)c2ccc(I)c(O)c2)ccc1F
InChIInChI=1S/C14H11FINO2/c1-8-6-10(3-4-11(8)15)17-14(19)9-2-5-12(16)13(18)7-9/h2-7,18H,1H3,(H,17,19)
InChIKeyWUIFHKFAYOPTBW-UHFFFAOYSA-N
XLogP3.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.15
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-fluoro-3-methylphenyl)-3,5-dihydroxybenzamide
CID 104938981
3-hydroxy-N-(4-hydroxyphenyl)-4-iodobenzamide
CID 104629586
4-chloro-N-(4-iodo-3-methylphenyl)benzamide
CID 587314
3-amino-4-bromo-N-(4-fluoro-3-methylphenyl)benzamide
CID 55118828
3-[(4-fluoro-3-methylphenyl)carbamoyl]benzoic acid
CID 62812413
[4-fluoro-3-[(4-fluoro-3-methylbenzoyl)amino]phenyl]carbamic acid
CID 137353520
3-hydroxy-4-iodo-N-(3-methylsulfanylphenyl)benzamide
CID 104627461
2-fluoro-5-[(3-hydroxy-4-methylbenzoyl)amino]benzoic acid
CID 60825323
N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide;hydrochloride
CID 110776367
4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide
CID 113342873
N-(3-chloro-4-fluorophenyl)-4-fluoro-3-methylbenzamide;formaldehyde
CID 144890602
N-(3-amino-4-fluorophenyl)-4-hydroxy-3-methylbenzamide
CID 107672026

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide?
The IUPAC name of N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide (CID 104628285) is N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide is Cc1cc(NC(=O)c2ccc(I)c(O)c2)ccc1F.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide?
The InChIKey is WUIFHKFAYOPTBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FINO2/c1-8-6-10(3-4-11(8)15)17-14(19)9-2-5-12(16)13(18)7-9/h2-7,18H,1H3,(H,17,19).
What are the key properties of N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide?
N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide has a molecular weight of 371.15 g/mol, XLogP of 3.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)-3-hydroxy-4-iodobenzamide is sourced from PubChem (CID 104628285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).