5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide

C14H10ClFINO — CID 113230081

IUPAC5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide
SMILESCN(C(=O)c1cc(Cl)ccc1I)c1ccccc1F
InChIInChI=1S/C14H10ClFINO/c1-18(13-5-3-2-4-11(13)16)14(19)10-8-9(15)6-7-12(10)17/h2-8H,1H3
InChIKeyRBHLQTJRZKVHCG-UHFFFAOYSA-N
MW389.60 g/mol
LogP4.36
Rot. Bonds2

About 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide

5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide (PubChem CID 113230081) has the molecular formula C14H10ClFINO and a molecular weight of 389.60 g/mol. Its IUPAC name is 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide.

Molecular Properties

Compound Name5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide
PubChem CID113230081
Molecular FormulaC14H10ClFINO
Molecular Weight389.60 g/mol
Exact Mass388.95
IUPAC Name5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide
SMILESCN(C(=O)c1cc(Cl)ccc1I)c1ccccc1F
InChIInChI=1S/C14H10ClFINO/c1-18(13-5-3-2-4-11(13)16)14(19)10-8-9(15)6-7-12(10)17/h2-8H,1H3
InChIKeyRBHLQTJRZKVHCG-UHFFFAOYSA-N
XLogP4.36
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.60
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-2-iodo-N-methyl-N-pyridin-3-ylbenzamide
CID 113236277
N-(2-fluorophenyl)-N-methyl-2-sulfanylbenzamide
CID 107027760
2-[(5-chloro-2-methylbenzoyl)-methylamino]benzoic acid
CID 82877765
N-(2-fluorophenyl)-3,5-dihydroxy-N-methylbenzamide
CID 107703878
5-amino-2-bromo-4-fluoro-N-(2-fluorophenyl)-N-methylbenzamide
CID 62815620
N-(2-fluorophenyl)-2,6-dihydroxy-N-methylbenzamide
CID 107689336
4-chloro-2-fluoro-N-methyl-N-phenylbenzamide
CID 56919945
2-[(2-chloro-3-fluorobenzoyl)-methylamino]benzoic acid
CID 81454401
5-chloro-2-iodo-N',N'-dimethylbenzohydrazide
CID 103626498
N-(1-amino-1-sulfanylidenepropan-2-yl)-5-chloro-2-iodo-N-methylbenzamide
CID 114030722
5-chloro-N-cyclohexyl-2-iodo-N-methylbenzamide
CID 113222858
2-chloro-N-(2-fluorophenyl)-N-methyl-3-nitropyridine-4-carboxamide
CID 64857632

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide?
The IUPAC name of 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide (CID 113230081) is 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide.
What is the SMILES notation for 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide?
The canonical SMILES for 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide is CN(C(=O)c1cc(Cl)ccc1I)c1ccccc1F.
What is the InChIKey of 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide?
The InChIKey is RBHLQTJRZKVHCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFINO/c1-18(13-5-3-2-4-11(13)16)14(19)10-8-9(15)6-7-12(10)17/h2-8H,1H3.
What are the key properties of 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide?
5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide has a molecular weight of 389.60 g/mol, XLogP of 4.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-fluorophenyl)-2-iodo-N-methylbenzamide is sourced from PubChem (CID 113230081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).