2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide

C14H10Cl2N2O — CID 689911

IUPAC2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide
SMILESO=C(NN=Cc1cccc(Cl)c1)c1ccccc1Cl
InChIInChI=1S/C14H10Cl2N2O/c15-11-5-3-4-10(8-11)9-17-18-14(19)12-6-1-2-7-13(12)16/h1-9H,(H,18,19)
InChIKeyGJZNVHWHYCAXHY-UHFFFAOYSA-N
MW293.15 g/mol
LogP3.76
Rot. Bonds3

About 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide

2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide (PubChem CID 689911) has the molecular formula C14H10Cl2N2O and a molecular weight of 293.15 g/mol. Its IUPAC name is 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide
PubChem CID689911
Molecular FormulaC14H10Cl2N2O
Molecular Weight293.15 g/mol
Exact Mass292.02
IUPAC Name2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide
SMILESO=C(NN=Cc1cccc(Cl)c1)c1ccccc1Cl
InChIInChI=1S/C14H10Cl2N2O/c15-11-5-3-4-10(8-11)9-17-18-14(19)12-6-1-2-7-13(12)16/h1-9H,(H,18,19)
InChIKeyGJZNVHWHYCAXHY-UHFFFAOYSA-N
XLogP3.76
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.15
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-N-[(E)-(3-chlorophenyl)methylideneamino]benzamide
CID 6899012
2-chloro-N-[(3-chlorophenyl)methylideneamino]-4-methylbenzamide
CID 71952071
2-N,6-N-bis[(E)-(3-chlorophenyl)methylideneamino]pyridine-2,6-dicarboxamide
CID 171981138
2-chloro-N-[(E)-(2,4-dichlorophenyl)methylideneamino]benzamide
CID 5332948
N-[(3-chlorophenyl)methylideneamino]-2-methylfuran-3-carboxamide
CID 870863
N-[(E)-(3-chlorophenyl)methylideneamino]-2-methylfuran-3-carboxamide
CID 5340130
N,N'-bis[(3-chlorophenyl)methylideneamino]propanediamide
CID 3386676
N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide
CID 6871246
2-chloro-N-[(Z)-(4-hydroxy-3-iodophenyl)methylideneamino]benzamide
CID 135642762
N-[(Z)-benzylideneamino]-3-chlorobenzamide
CID 5409510
2-chloro-N-[(4-hydroxy-3,5-dimethylphenyl)methylideneamino]benzamide
CID 4002314
N-[4-[[(3-chlorophenyl)methylideneamino]carbamoyl]phenyl]-2-methylbenzamide
CID 3376596

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide?
The IUPAC name of 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide (CID 689911) is 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide.
What is the SMILES notation for 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide?
The canonical SMILES for 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide is O=C(NN=Cc1cccc(Cl)c1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide?
The InChIKey is GJZNVHWHYCAXHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2O/c15-11-5-3-4-10(8-11)9-17-18-14(19)12-6-1-2-7-13(12)16/h1-9H,(H,18,19).
What are the key properties of 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide?
2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide has a molecular weight of 293.15 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide is sourced from PubChem (CID 689911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).