N-(4-chlorophenyl)-4-(iodomethyl)benzamide

C14H11ClINO — CID 147537522

IUPACN-(4-chlorophenyl)-4-(iodomethyl)benzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc(CI)cc1
InChIInChI=1S/C14H11ClINO/c15-12-5-7-13(8-6-12)17-14(18)11-3-1-10(9-16)2-4-11/h1-8H,9H2,(H,17,18)
InChIKeyFOGIZHXXAGWOIL-UHFFFAOYSA-N
MW371.61 g/mol
LogP4.53
Rot. Bonds3

About N-(4-chlorophenyl)-4-(iodomethyl)benzamide

N-(4-chlorophenyl)-4-(iodomethyl)benzamide (PubChem CID 147537522) has the molecular formula C14H11ClINO and a molecular weight of 371.61 g/mol. Its IUPAC name is N-(4-chlorophenyl)-4-(iodomethyl)benzamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-4-(iodomethyl)benzamide
PubChem CID147537522
Molecular FormulaC14H11ClINO
Molecular Weight371.61 g/mol
Exact Mass370.96
IUPAC NameN-(4-chlorophenyl)-4-(iodomethyl)benzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc(CI)cc1
InChIInChI=1S/C14H11ClINO/c15-12-5-7-13(8-6-12)17-14(18)11-3-1-10(9-16)2-4-11/h1-8H,9H2,(H,17,18)
InChIKeyFOGIZHXXAGWOIL-UHFFFAOYSA-N
XLogP4.53
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.61
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(4-chlorophenyl)-4-(iodomethyl)benzamide 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

4-(chloromethyl)-N-(4-chlorophenyl)benzamide
CID 43333316
N-(4-chlorophenyl)-4-(methylamino)benzamide
CID 62166017
2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
N-(4-chlorophenyl)-4-(ethylsulfonylamino)benzamide
CID 92643113
N-(4-chlorophenyl)-4-[(E)-2-[4-[(4-chlorophenyl)carbamoyl]phenyl]ethenyl]benzamide
CID 134119182
4-chloro-N-[4-(4-chlorophenyl)sulfanylphenyl]benzamide
CID 12734406
N-(4-chlorophenyl)benzamide;hydrochloride
CID 139912610
N-[4-[(4-chlorophenyl)methylamino]phenyl]benzamide
CID 112982578
N-(4-anilinophenyl)-4-chlorobenzamide
CID 681104
N-[4-[[(4-chlorobenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1100705
N-(4-chlorophenyl)-4-(2-pyrrolidin-1-ylethyl)benzamide
CID 70967822
4-chloro-N-[4-(prop-2-enoylamino)phenyl]benzamide
CID 166410938

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-4-(iodomethyl)benzamide?
The IUPAC name of N-(4-chlorophenyl)-4-(iodomethyl)benzamide (CID 147537522) is N-(4-chlorophenyl)-4-(iodomethyl)benzamide.
What is the SMILES notation for N-(4-chlorophenyl)-4-(iodomethyl)benzamide?
The canonical SMILES for N-(4-chlorophenyl)-4-(iodomethyl)benzamide is O=C(Nc1ccc(Cl)cc1)c1ccc(CI)cc1.
What is the InChIKey of N-(4-chlorophenyl)-4-(iodomethyl)benzamide?
The InChIKey is FOGIZHXXAGWOIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClINO/c15-12-5-7-13(8-6-12)17-14(18)11-3-1-10(9-16)2-4-11/h1-8H,9H2,(H,17,18).
What are the key properties of N-(4-chlorophenyl)-4-(iodomethyl)benzamide?
N-(4-chlorophenyl)-4-(iodomethyl)benzamide has a molecular weight of 371.61 g/mol, XLogP of 4.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-4-(iodomethyl)benzamide is sourced from PubChem (CID 147537522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).