N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide

C9H8Cl2N2O — CID 6294643

IUPACN-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide
SMILESCC(=O)N/N=C\c1cccc(Cl)c1Cl
InChIInChI=1S/C9H8Cl2N2O/c1-6(14)13-12-5-7-3-2-4-8(10)9(7)11/h2-5H,1H3,(H,13,14)/b12-5-
InChIKeyZDXCDGJGOBHSIS-XGICHPGQSA-N
MW231.08 g/mol
LogP2.46
Rot. Bonds2

About N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide

N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide (PubChem CID 6294643) has the molecular formula C9H8Cl2N2O and a molecular weight of 231.08 g/mol. Its IUPAC name is N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide.

Molecular Properties

Compound NameN-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide
PubChem CID6294643
Molecular FormulaC9H8Cl2N2O
Molecular Weight231.08 g/mol
Exact Mass230.00
IUPAC NameN-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide
SMILESCC(=O)N/N=C\c1cccc(Cl)c1Cl
InChIInChI=1S/C9H8Cl2N2O/c1-6(14)13-12-5-7-3-2-4-8(10)9(7)11/h2-5H,1H3,(H,13,14)/b12-5-
InChIKeyZDXCDGJGOBHSIS-XGICHPGQSA-N
XLogP2.46
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.08
LogP ≤ 52.46
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

N-[(E)-(2,3-dichlorophenyl)methylideneamino]propanamide
CID 154646210
N'-[(Z)-(2,3-dichlorophenyl)methylideneamino]-N-propan-2-yloxamide
CID 9351462
N-[(E)-(2,3-dichlorophenyl)methylideneamino]-4-methylbenzamide
CID 5333191
N-[(E)-(2,3-dichlorophenyl)methylideneamino]-2-[2-[(2E)-2-[(2,3-dichlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]sulfanylacetamide
CID 171981130
N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2-methylbenzamide
CID 5404066
3-chloro-N-[(Z)-(2,3-dichlorophenyl)methylideneamino]benzamide
CID 5407459
N-[(E)-(2,3-dichlorophenyl)methylideneamino]-4-propan-2-ylbenzamide
CID 6874265
2-bromo-N-[(2,3-dichlorophenyl)methylideneamino]benzamide
CID 3322799
N-[(2,3-dichlorophenyl)methylideneamino]-2-oxo-2-pyrrolidin-1-ylacetamide
CID 2263908
N-[(2,3-dichlorophenyl)methylideneamino]-2-(4-methylanilino)acetamide
CID 872216
N-[(2-chloro-6-fluorophenyl)methylideneamino]acetamide
CID 4166236
(2S)-N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2-[(2,2-diphenylacetyl)amino]-3-methylbutanamide
CID 27877587

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide?
The IUPAC name of N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide (CID 6294643) is N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide.
What is the SMILES notation for N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide?
The canonical SMILES for N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide is CC(=O)N/N=C\c1cccc(Cl)c1Cl.
What is the InChIKey of N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide?
The InChIKey is ZDXCDGJGOBHSIS-XGICHPGQSA-N. The full InChI is InChI=1S/C9H8Cl2N2O/c1-6(14)13-12-5-7-3-2-4-8(10)9(7)11/h2-5H,1H3,(H,13,14)/b12-5-.
What are the key properties of N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide?
N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide has a molecular weight of 231.08 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,3-dichlorophenyl)methylideneamino]acetamide is sourced from PubChem (CID 6294643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).