2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide

C15H12Cl2N2O2 — CID 6167444

IUPAC2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide
SMILESC/C(=N/NC(=O)c1ccc(Cl)cc1Cl)c1cccc(O)c1
InChIInChI=1S/C15H12Cl2N2O2/c1-9(10-3-2-4-12(20)7-10)18-19-15(21)13-6-5-11(16)8-14(13)17/h2-8,20H,1H3,(H,19,21)/b18-9-
InChIKeyFYXSFMMUSYOVAJ-NVMNQCDNSA-N
MW323.18 g/mol
LogP3.85
Rot. Bonds3

About 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide

2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide (PubChem CID 6167444) has the molecular formula C15H12Cl2N2O2 and a molecular weight of 323.18 g/mol. Its IUPAC name is 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide
PubChem CID6167444
Molecular FormulaC15H12Cl2N2O2
Molecular Weight323.18 g/mol
Exact Mass322.03
IUPAC Name2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide
SMILESC/C(=N/NC(=O)c1ccc(Cl)cc1Cl)c1cccc(O)c1
InChIInChI=1S/C15H12Cl2N2O2/c1-9(10-3-2-4-12(20)7-10)18-19-15(21)13-6-5-11(16)8-14(13)17/h2-8,20H,1H3,(H,19,21)/b18-9-
InChIKeyFYXSFMMUSYOVAJ-NVMNQCDNSA-N
XLogP3.85
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.18
LogP ≤ 53.85
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

2,4-dichloro-N-[1-(4-chlorophenyl)ethylideneamino]benzamide
CID 904479
2,4-dichloro-N-[3-[N-[(2-chlorobenzoyl)amino]-C-methylcarbonimidoyl]phenyl]benzamide
CID 5078107
2,4-dichloro-N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide
CID 135688205
N-[(Z)-1-[3-[(2,4-dichlorobenzoyl)amino]phenyl]ethylideneamino]naphthalene-1-carboxamide
CID 6117391
2,4-dichloro-N-[4-[(Z)-N-[(3-chlorobenzoyl)amino]-C-methylcarbonimidoyl]phenyl]benzamide
CID 6266458
2,4-dichloro-N-[1-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]ethylideneamino]benzamide
CID 3699366
N-[1-(2,4-dichlorophenyl)ethylideneamino]-2,4-dihydroxybenzamide
CID 3626855
3,5-dihydroxy-N-[(E)-1-(3-hydroxyphenyl)ethylideneamino]benzamide
CID 17126860
2,4-dichloro-N-[3-[(Z)-N-[(3-fluorobenzoyl)amino]-C-methylcarbonimidoyl]phenyl]benzamide
CID 6266105
2,4-dichloro-N-[(Z)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylideneamino]benzamide
CID 6184678
2-bromo-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide
CID 6084875
2,4-dichloro-N-[3-[C-methyl-N-[(3-nitrobenzoyl)amino]carbonimidoyl]phenyl]benzamide
CID 3591047

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide?
The IUPAC name of 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide (CID 6167444) is 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide?
The canonical SMILES for 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide is C/C(=N/NC(=O)c1ccc(Cl)cc1Cl)c1cccc(O)c1.
What is the InChIKey of 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide?
The InChIKey is FYXSFMMUSYOVAJ-NVMNQCDNSA-N. The full InChI is InChI=1S/C15H12Cl2N2O2/c1-9(10-3-2-4-12(20)7-10)18-19-15(21)13-6-5-11(16)8-14(13)17/h2-8,20H,1H3,(H,19,21)/b18-9-.
What are the key properties of 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide?
2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide has a molecular weight of 323.18 g/mol, XLogP of 3.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[(Z)-1-(3-hydroxyphenyl)ethylideneamino]benzamide is sourced from PubChem (CID 6167444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).