N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide

C18H12ClIN2O3 — CID 1305585

IUPACN-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(I)cc1C(=O)Nc1ccccc1Cl)c1ccco1
InChIInChI=1S/C18H12ClIN2O3/c19-13-4-1-2-5-15(13)22-17(23)12-10-11(20)7-8-14(12)21-18(24)16-6-3-9-25-16/h1-10H,(H,21,24)(H,22,23)
InChIKeyOQMOIPFKKLAULO-UHFFFAOYSA-N
MW466.66 g/mol
LogP5.04
Rot. Bonds4

About N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide

N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide (PubChem CID 1305585) has the molecular formula C18H12ClIN2O3 and a molecular weight of 466.66 g/mol. Its IUPAC name is N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide
PubChem CID1305585
Molecular FormulaC18H12ClIN2O3
Molecular Weight466.66 g/mol
Exact Mass465.96
IUPAC NameN-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(I)cc1C(=O)Nc1ccccc1Cl)c1ccco1
InChIInChI=1S/C18H12ClIN2O3/c19-13-4-1-2-5-15(13)22-17(23)12-10-11(20)7-8-14(12)21-18(24)16-6-3-9-25-16/h1-10H,(H,21,24)(H,22,23)
InChIKeyOQMOIPFKKLAULO-UHFFFAOYSA-N
XLogP5.04
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.66
LogP ≤ 55.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide 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

N-[2-chloro-4-[(2-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 4308074
N-(2,4-dichlorophenyl)furan-2-carboxamide
CID 3105425
N-[4-chloro-2-(naphthalen-1-ylcarbamoyl)phenyl]furan-2-carboxamide
CID 991449
N-[(2-chlorophenyl)carbamoyl]furan-2-carboxamide
CID 110866393
N-(4-iodo-2-methylphenyl)furan-2-carboxamide
CID 723686
N-[2-[(4-chlorophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 722967
5-chloro-2-(furan-2-carbonylamino)benzoic acid
CID 16777457
N-[4-[(2-chlorophenyl)carbamothioylamino]phenyl]furan-2-carboxamide
CID 57081310
N-[4-iodo-2-(4-methylpiperazine-1-carbonyl)phenyl]furan-2-carboxamide
CID 1289803
N-[2-[[3-[(2-chlorophenyl)sulfamoyl]phenyl]carbamoyl]phenyl]furan-2-carboxamide
CID 39891473
N-[2-(2-chlorophenoxy)phenyl]furan-2-carboxamide
CID 17468939
N-[4-[(2-chlorobenzoyl)amino]-3-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 43041357

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide?
The IUPAC name of N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide (CID 1305585) is N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide is O=C(Nc1ccc(I)cc1C(=O)Nc1ccccc1Cl)c1ccco1.
What is the InChIKey of N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide?
The InChIKey is OQMOIPFKKLAULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClIN2O3/c19-13-4-1-2-5-15(13)22-17(23)12-10-11(20)7-8-14(12)21-18(24)16-6-3-9-25-16/h1-10H,(H,21,24)(H,22,23).
What are the key properties of N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide?
N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide has a molecular weight of 466.66 g/mol, XLogP of 5.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-chlorophenyl)carbamoyl]-4-iodophenyl]furan-2-carboxamide is sourced from PubChem (CID 1305585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).