N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide

C14H10ClIN2O — CID 5435276

IUPACN-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide
SMILESO=C(N/N=C\c1ccccc1Cl)c1cccc(I)c1
InChIInChI=1S/C14H10ClIN2O/c15-13-7-2-1-4-11(13)9-17-18-14(19)10-5-3-6-12(16)8-10/h1-9H,(H,18,19)/b17-9-
InChIKeyARUKMZXNFOGCJN-MFOYZWKCSA-N
MW384.60 g/mol
LogP3.71
Rot. Bonds3

About N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide

N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide (PubChem CID 5435276) has the molecular formula C14H10ClIN2O and a molecular weight of 384.60 g/mol. Its IUPAC name is N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide.

Molecular Properties

Compound NameN-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide
PubChem CID5435276
Molecular FormulaC14H10ClIN2O
Molecular Weight384.60 g/mol
Exact Mass383.95
IUPAC NameN-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide
SMILESO=C(N/N=C\c1ccccc1Cl)c1cccc(I)c1
InChIInChI=1S/C14H10ClIN2O/c15-13-7-2-1-4-11(13)9-17-18-14(19)10-5-3-6-12(16)8-10/h1-9H,(H,18,19)/b17-9-
InChIKeyARUKMZXNFOGCJN-MFOYZWKCSA-N
XLogP3.71
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.60
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3,4-dichloro-N-[(2-chlorophenyl)methylideneamino]benzamide
CID 780461
3-iodo-N-[(E)-(2-nitrophenyl)methylideneamino]benzamide
CID 5332346
N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodo-4-methoxybenzamide
CID 6117681
3-bromo-N-[(2-chlorophenyl)methylideneamino]-4-methylbenzamide
CID 5196692
N-[(Z)-[4-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-3-iodobenzamide
CID 94847954
3-chloro-N-[(Z)-(2,3-dichlorophenyl)methylideneamino]benzamide
CID 5407459
N-[(2-chlorophenyl)methylideneamino]-4-propan-2-ylbenzamide
CID 3705620
N-[(Z)-(5-chloro-2-hydroxy-3-methoxyphenyl)methylideneamino]-3-iodobenzamide
CID 135533719
N-[(E)-(2-chlorophenyl)methylideneamino]-4-nitrobenzamide
CID 7290572
N-[(Z)-(2-chlorophenyl)methylideneamino]-4-(dimethylamino)benzamide
CID 6172930
3-iodo-N-[(Z)-(3-methylphenyl)methylideneamino]benzamide
CID 5499709
N-[(Z)-(2-chlorophenyl)methylideneamino]-4-methoxybenzamide
CID 5404314

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide?
The IUPAC name of N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide (CID 5435276) is N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide.
What is the SMILES notation for N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide?
The canonical SMILES for N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide is O=C(N/N=C\c1ccccc1Cl)c1cccc(I)c1.
What is the InChIKey of N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide?
The InChIKey is ARUKMZXNFOGCJN-MFOYZWKCSA-N. The full InChI is InChI=1S/C14H10ClIN2O/c15-13-7-2-1-4-11(13)9-17-18-14(19)10-5-3-6-12(16)8-10/h1-9H,(H,18,19)/b17-9-.
What are the key properties of N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide?
N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide has a molecular weight of 384.60 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-chlorophenyl)methylideneamino]-3-iodobenzamide is sourced from PubChem (CID 5435276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).