2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide

C15H14ClN3O — CID 5332716

IUPAC2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide
SMILESC/C(=N/NC(=O)c1ccccc1N)c1ccccc1Cl
InChIInChI=1S/C15H14ClN3O/c1-10(11-6-2-4-8-13(11)16)18-19-15(20)12-7-3-5-9-14(12)17/h2-9H,17H2,1H3,(H,19,20)/b18-10-
InChIKeyHGODELXMDCDIOJ-ZDLGFXPLSA-N
MW287.75 g/mol
LogP3.08
Rot. Bonds3

About 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide

2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide (PubChem CID 5332716) has the molecular formula C15H14ClN3O and a molecular weight of 287.75 g/mol. Its IUPAC name is 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide.

Molecular Properties

Compound Name2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide
PubChem CID5332716
Molecular FormulaC15H14ClN3O
Molecular Weight287.75 g/mol
Exact Mass287.08
IUPAC Name2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide
SMILESC/C(=N/NC(=O)c1ccccc1N)c1ccccc1Cl
InChIInChI=1S/C15H14ClN3O/c1-10(11-6-2-4-8-13(11)16)18-19-15(20)12-7-3-5-9-14(12)17/h2-9H,17H2,1H3,(H,19,20)/b18-10-
InChIKeyHGODELXMDCDIOJ-ZDLGFXPLSA-N
XLogP3.08
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135688203
2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide
CID 137150949
2-chloro-N-[1-(2,3,4-trichlorophenyl)ethylideneamino]benzamide
CID 3997107
N-[1-(2-chlorophenyl)ethylideneamino]-4-fluorobenzamide
CID 4123308
2-amino-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]benzamide
CID 21370947
3-bromo-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide
CID 5332759
2-amino-N-[(2,6-dichlorophenyl)methylideneamino]benzamide
CID 680916
4-bromo-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]-1H-pyrrole-2-carboxamide
CID 8982528
2-amino-N-[1-(4-nitrophenyl)ethylideneamino]benzamide
CID 796032
2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135472588
N-[(Z)-1-(2-chlorophenyl)ethylideneamino]pyrazine-2-carboxamide
CID 5422251
2-chloro-N-[(Z)-1-(2,5-dimethylfuran-3-yl)ethylideneamino]benzamide
CID 6156048

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide?
The IUPAC name of 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide (CID 5332716) is 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide.
What is the SMILES notation for 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide?
The canonical SMILES for 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide is C/C(=N/NC(=O)c1ccccc1N)c1ccccc1Cl.
What is the InChIKey of 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide?
The InChIKey is HGODELXMDCDIOJ-ZDLGFXPLSA-N. The full InChI is InChI=1S/C15H14ClN3O/c1-10(11-6-2-4-8-13(11)16)18-19-15(20)12-7-3-5-9-14(12)17/h2-9H,17H2,1H3,(H,19,20)/b18-10-.
What are the key properties of 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide?
2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide has a molecular weight of 287.75 g/mol, XLogP of 3.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide is sourced from PubChem (CID 5332716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).