2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide

C15H15N3O3 — CID 137150949

IUPAC2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide
SMILESC/C(=N/NC(=O)c1ccccc1N)c1ccc(O)cc1O
InChIInChI=1S/C15H15N3O3/c1-9(11-7-6-10(19)8-14(11)20)17-18-15(21)12-4-2-3-5-13(12)16/h2-8,19-20H,16H2,1H3,(H,18,21)/b17-9-
InChIKeyJIFYVJSWAMUMQU-MFOYZWKCSA-N
MW285.30 g/mol
LogP1.83
Rot. Bonds3

About 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide

2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide (PubChem CID 137150949) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide.

Molecular Properties

Compound Name2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide
PubChem CID137150949
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide
SMILESC/C(=N/NC(=O)c1ccccc1N)c1ccc(O)cc1O
InChIInChI=1S/C15H15N3O3/c1-9(11-7-6-10(19)8-14(11)20)17-18-15(21)12-4-2-3-5-13(12)16/h2-8,19-20H,16H2,1H3,(H,18,21)/b17-9-
InChIKeyJIFYVJSWAMUMQU-MFOYZWKCSA-N
XLogP1.83
TPSA107.94 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'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

N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-hydroxybenzamide
CID 708171
N-[(E)-1-(2,5-dihydroxyphenyl)ethylideneamino]-2-hydroxybenzamide
CID 135554989
2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide
CID 5332716
2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135472588
2,4-dichloro-N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide
CID 135688205
N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]furan-2-carboxamide
CID 135644319
1-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]-3-phenylurea
CID 135643114
2,4-dihydroxy-N-(1-pyridin-2-ylethylideneamino)benzamide
CID 872905
2-amino-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]benzamide
CID 21370947
N-[1-(2,4-dichlorophenyl)ethylideneamino]-2,4-dihydroxybenzamide
CID 3626855
3-bromo-N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]-4-methylbenzamide
CID 135418721
2-chloro-N-[2-[(2E)-2-[1-(2,4-dihydroxyphenyl)ethylidene]hydrazinyl]-2-oxoethyl]benzamide
CID 135648810

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide?
The IUPAC name of 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide (CID 137150949) is 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide.
What is the SMILES notation for 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide?
The canonical SMILES for 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide is C/C(=N/NC(=O)c1ccccc1N)c1ccc(O)cc1O.
What is the InChIKey of 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide?
The InChIKey is JIFYVJSWAMUMQU-MFOYZWKCSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-9(11-7-6-10(19)8-14(11)20)17-18-15(21)12-4-2-3-5-13(12)16/h2-8,19-20H,16H2,1H3,(H,18,21)/b17-9-.
What are the key properties of 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide?
2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide has a molecular weight of 285.30 g/mol, XLogP of 1.83, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]benzamide is sourced from PubChem (CID 137150949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).