5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide

C14H12ClN3O2 — CID 5410349

IUPAC5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide
SMILESNc1ccc(O)c(C(=O)N/N=C\c2ccc(Cl)cc2)c1
InChIInChI=1S/C14H12ClN3O2/c15-10-3-1-9(2-4-10)8-17-18-14(20)12-7-11(16)5-6-13(12)19/h1-8,19H,16H2,(H,18,20)/b17-8-
InChIKeyFPFVYRGZHDPIDT-IUXPMGMMSA-N
MW289.72 g/mol
LogP2.39
Rot. Bonds3

About 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide

5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide (PubChem CID 5410349) has the molecular formula C14H12ClN3O2 and a molecular weight of 289.72 g/mol. Its IUPAC name is 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide
PubChem CID5410349
Molecular FormulaC14H12ClN3O2
Molecular Weight289.72 g/mol
Exact Mass289.06
IUPAC Name5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide
SMILESNc1ccc(O)c(C(=O)N/N=C\c2ccc(Cl)cc2)c1
InChIInChI=1S/C14H12ClN3O2/c15-10-3-1-9(2-4-10)8-17-18-14(20)12-7-11(16)5-6-13(12)19/h1-8,19H,16H2,(H,18,20)/b17-8-
InChIKeyFPFVYRGZHDPIDT-IUXPMGMMSA-N
XLogP2.39
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.72
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', '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

5-amino-N-[[4-(dimethylamino)phenyl]methylideneamino]-2-hydroxybenzamide
CID 4604645
5-chloro-N-[(3,4-dimethoxyphenyl)methylideneamino]-2-hydroxybenzamide
CID 5057069
[(Z)-(4-chlorophenyl)methylideneamino]urea
CID 6079769
4-chloro-2-hydroxy-N-(pyridin-4-ylmethylideneamino)benzamide
CID 867441
5-bromo-2-hydroxy-N-[(4-methylphenyl)methylideneamino]benzamide
CID 867247
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-5-chloro-2-hydroxybenzamide
CID 135615369
N-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-hydroxy-5-nitrobenzamide
CID 126061280
N-[(Z)-(5-chloro-2-hydroxyphenyl)methylideneamino]-2-hydroxybenzamide
CID 135641867
4-chloro-2-N-[(4-fluorophenyl)methylideneamino]benzene-1,2-dicarboxamide
CID 67494565
1-amino-3-[(E)-(4-chlorophenyl)methylideneamino]urea
CID 88822075
5-chloro-N-[(3,4-dihydroxyphenyl)methylideneamino]-2-methoxybenzamide
CID 840452
5-chloro-2-hydroxy-N-[(Z)-(2,4,6-trimethoxyphenyl)methylideneamino]benzamide
CID 9297823

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide?
The IUPAC name of 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide (CID 5410349) is 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide.
What is the SMILES notation for 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide?
The canonical SMILES for 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide is Nc1ccc(O)c(C(=O)N/N=C\c2ccc(Cl)cc2)c1.
What is the InChIKey of 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide?
The InChIKey is FPFVYRGZHDPIDT-IUXPMGMMSA-N. The full InChI is InChI=1S/C14H12ClN3O2/c15-10-3-1-9(2-4-10)8-17-18-14(20)12-7-11(16)5-6-13(12)19/h1-8,19H,16H2,(H,18,20)/b17-8-.
What are the key properties of 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide?
5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide has a molecular weight of 289.72 g/mol, XLogP of 2.39, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[(Z)-(4-chlorophenyl)methylideneamino]-2-hydroxybenzamide is sourced from PubChem (CID 5410349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).