2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide

C15H13ClN2O2 — CID 135688203

IUPAC2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
SMILESC/C(=N\NC(=O)c1ccccc1Cl)c1ccccc1O
InChIInChI=1S/C15H13ClN2O2/c1-10(11-6-3-5-9-14(11)19)17-18-15(20)12-7-2-4-8-13(12)16/h2-9,19H,1H3,(H,18,20)/b17-10+
InChIKeyPMGOZQVNKAXTHT-LICLKQGHSA-N
MW288.73 g/mol
LogP3.20
Rot. Bonds3

About 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide

2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide (PubChem CID 135688203) has the molecular formula C15H13ClN2O2 and a molecular weight of 288.73 g/mol. Its IUPAC name is 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide.

Molecular Properties

Compound Name2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
PubChem CID135688203
Molecular FormulaC15H13ClN2O2
Molecular Weight288.73 g/mol
Exact Mass288.07
IUPAC Name2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
SMILESC/C(=N\NC(=O)c1ccccc1Cl)c1ccccc1O
InChIInChI=1S/C15H13ClN2O2/c1-10(11-6-3-5-9-14(11)19)17-18-15(20)12-7-2-4-8-13(12)16/h2-9,19H,1H3,(H,18,20)/b17-10+
InChIKeyPMGOZQVNKAXTHT-LICLKQGHSA-N
XLogP3.20
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.73
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', '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

2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135472588
2-chloro-N-[(E)-1-(2-hydroxy-5-methoxyphenyl)ethylideneamino]benzamide
CID 135824437
2-chloro-N-[1-(2,3,4-trichlorophenyl)ethylideneamino]benzamide
CID 3997107
N-[1-(2-hydroxyphenyl)ethylideneamino]-2-(methylamino)benzamide
CID 136660084
2-amino-N-[(Z)-1-(2-chlorophenyl)ethylideneamino]benzamide
CID 5332716
2-chloro-N-[1-(2-hydroxy-3-methoxyphenyl)ethylideneamino]benzamide
CID 137028983
N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-hydroxybenzamide
CID 708171
N-[(Z)-1-(2-hydroxyphenyl)ethylideneamino]-2-methoxybenzamide
CID 144899093
1-N,3-N-bis[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzene-1,3-dicarboxamide
CID 135656933
2-chloro-N-[(Z)-1-(2,5-dimethylfuran-3-yl)ethylideneamino]benzamide
CID 6156048
3-(2-chlorophenyl)-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-1H-pyrazole-5-carboxamide
CID 135547180
N-[(E)-1-(2,5-dihydroxyphenyl)ethylideneamino]-2-hydroxybenzamide
CID 135554989

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide?
The IUPAC name of 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide (CID 135688203) is 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide.
What is the SMILES notation for 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide?
The canonical SMILES for 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide is C/C(=N\NC(=O)c1ccccc1Cl)c1ccccc1O.
What is the InChIKey of 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide?
The InChIKey is PMGOZQVNKAXTHT-LICLKQGHSA-N. The full InChI is InChI=1S/C15H13ClN2O2/c1-10(11-6-3-5-9-14(11)19)17-18-15(20)12-7-2-4-8-13(12)16/h2-9,19H,1H3,(H,18,20)/b17-10+.
What are the key properties of 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide?
2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide has a molecular weight of 288.73 g/mol, XLogP of 3.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide is sourced from PubChem (CID 135688203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).