N-(3-chlorophenyl)-3-iodo-4-methylbenzamide

C14H11ClINO — CID 1014193

IUPACN-(3-chlorophenyl)-3-iodo-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2cccc(Cl)c2)cc1I
InChIInChI=1S/C14H11ClINO/c1-9-5-6-10(7-13(9)16)14(18)17-12-4-2-3-11(15)8-12/h2-8H,1H3,(H,17,18)
InChIKeyXZWLEOXWEHYHHN-UHFFFAOYSA-N
MW371.61 g/mol
LogP4.51
Rot. Bonds2

About N-(3-chlorophenyl)-3-iodo-4-methylbenzamide

N-(3-chlorophenyl)-3-iodo-4-methylbenzamide (PubChem CID 1014193) has the molecular formula C14H11ClINO and a molecular weight of 371.61 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-iodo-4-methylbenzamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-iodo-4-methylbenzamide
PubChem CID1014193
Molecular FormulaC14H11ClINO
Molecular Weight371.61 g/mol
Exact Mass370.96
IUPAC NameN-(3-chlorophenyl)-3-iodo-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2cccc(Cl)c2)cc1I
InChIInChI=1S/C14H11ClINO/c1-9-5-6-10(7-13(9)16)14(18)17-12-4-2-3-11(15)8-12/h2-8H,1H3,(H,17,18)
InChIKeyXZWLEOXWEHYHHN-UHFFFAOYSA-N
XLogP4.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.61
LogP ≤ 54.51
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-(3-carbamoylphenyl)-3-iodo-4-methylbenzamide
CID 26160460
4-amino-N-(3-chlorophenyl)-3-methylbenzamide
CID 16785313
3-chloro-N-(4-iodo-3-methylphenyl)benzamide
CID 1340030
N-[3-(dimethylcarbamoyl)phenyl]-3-iodo-4-methylbenzamide
CID 17231812
N-[3-(tert-butylcarbamoyl)phenyl]-3-iodo-4-methylbenzamide
CID 28639414
3,5-dichloro-N-(3-iodo-4-methylphenyl)benzamide
CID 7925565
N-(4-acetamidophenyl)-3-iodo-4-methylbenzamide
CID 1014195
3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981
3-chloro-N-(3-methylphenyl)benzamide
CID 722373
3-bromo-4-chloro-N-(3-iodo-4-methylphenyl)benzamide
CID 107999380
N-(3-chlorophenyl)-4-propan-2-ylbenzamide
CID 1406456
N-(2,3-dimethylphenyl)-3-iodo-4-methylbenzamide
CID 2213666

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-iodo-4-methylbenzamide?
The IUPAC name of N-(3-chlorophenyl)-3-iodo-4-methylbenzamide (CID 1014193) is N-(3-chlorophenyl)-3-iodo-4-methylbenzamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-iodo-4-methylbenzamide?
The canonical SMILES for N-(3-chlorophenyl)-3-iodo-4-methylbenzamide is Cc1ccc(C(=O)Nc2cccc(Cl)c2)cc1I.
What is the InChIKey of N-(3-chlorophenyl)-3-iodo-4-methylbenzamide?
The InChIKey is XZWLEOXWEHYHHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClINO/c1-9-5-6-10(7-13(9)16)14(18)17-12-4-2-3-11(15)8-12/h2-8H,1H3,(H,17,18).
What are the key properties of N-(3-chlorophenyl)-3-iodo-4-methylbenzamide?
N-(3-chlorophenyl)-3-iodo-4-methylbenzamide has a molecular weight of 371.61 g/mol, XLogP of 4.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-iodo-4-methylbenzamide is sourced from PubChem (CID 1014193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).