N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide

C15H14ClN3O — CID 5427716

IUPACN-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide
SMILESO=C(CNc1ccccc1Cl)N/N=C\c1ccccc1
InChIInChI=1S/C15H14ClN3O/c16-13-8-4-5-9-14(13)17-11-15(20)19-18-10-12-6-2-1-3-7-12/h1-10,17H,11H2,(H,19,20)/b18-10-
InChIKeyRDLMGXNQMPHZQZ-ZDLGFXPLSA-N
MW287.75 g/mol
LogP2.90
Rot. Bonds5

About N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide

N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide (PubChem CID 5427716) has the molecular formula C15H14ClN3O and a molecular weight of 287.75 g/mol. Its IUPAC name is N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide.

Molecular Properties

Compound NameN-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide
PubChem CID5427716
Molecular FormulaC15H14ClN3O
Molecular Weight287.75 g/mol
Exact Mass287.08
IUPAC NameN-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide
SMILESO=C(CNc1ccccc1Cl)N/N=C\c1ccccc1
InChIInChI=1S/C15H14ClN3O/c16-13-8-4-5-9-14(13)17-11-15(20)19-18-10-12-6-2-1-3-7-12/h1-10,17H,11H2,(H,19,20)/b18-10-
InChIKeyRDLMGXNQMPHZQZ-ZDLGFXPLSA-N
XLogP2.90
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

N-(benzylideneamino)-2-(3-chloro-2-methylanilino)acetamide
CID 968237
2-(2-chloroanilino)-N-[(Z)-(3-chlorophenyl)methylideneamino]acetamide
CID 5427729
2-(2-chloroanilino)-N-[(3-hydroxyphenyl)methylideneamino]acetamide
CID 695102
2-(2-chloroanilino)-N-[(4-cyanophenyl)methylideneamino]acetamide
CID 967968
2-(2-chloroanilino)-N-[(3,5-dibromo-4-hydroxyphenyl)methylideneamino]acetamide
CID 136649492
2-(2-chloroanilino)-N-[(2-methylphenyl)methylideneamino]acetamide
CID 968113
2-(2-chloroanilino)-N-[(Z)-(3,5-dichloro-2-hydroxyphenyl)methylideneamino]acetamide
CID 136866501
N-(2-chlorophenyl)-N'-[(4-hydroxyphenyl)methylideneamino]butanediamide
CID 3591287
N-(benzylideneamino)-2-(2,4-dimethylanilino)acetamide
CID 967979
N-[(3,4-dichlorophenyl)methylideneamino]-2-(2-methylanilino)acetamide
CID 4111290
N-(benzylideneamino)-2-(4-methylanilino)acetamide
CID 689462
N-(2-chlorophenyl)-N'-[(4-fluorophenyl)methylideneamino]propanediamide
CID 3974770

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide?
The IUPAC name of N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide (CID 5427716) is N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide.
What is the SMILES notation for N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide?
The canonical SMILES for N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide is O=C(CNc1ccccc1Cl)N/N=C\c1ccccc1.
What is the InChIKey of N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide?
The InChIKey is RDLMGXNQMPHZQZ-ZDLGFXPLSA-N. The full InChI is InChI=1S/C15H14ClN3O/c16-13-8-4-5-9-14(13)17-11-15(20)19-18-10-12-6-2-1-3-7-12/h1-10,17H,11H2,(H,19,20)/b18-10-.
What are the key properties of N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide?
N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide has a molecular weight of 287.75 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-benzylideneamino]-2-(2-chloroanilino)acetamide is sourced from PubChem (CID 5427716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).