2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide

C19H15ClN2O2 — CID 6870033

IUPAC2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
SMILESCOc1ccc(/C=N/NC(=O)c2ccccc2Cl)c2ccccc12
InChIInChI=1S/C19H15ClN2O2/c1-24-18-11-10-13(14-6-2-3-7-15(14)18)12-21-22-19(23)16-8-4-5-9-17(16)20/h2-12H,1H3,(H,22,23)/b21-12+
InChIKeyZKWXXONSVHWTMG-CIAFOILYSA-N
MW338.79 g/mol
LogP4.27
Rot. Bonds4

About 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide

2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide (PubChem CID 6870033) has the molecular formula C19H15ClN2O2 and a molecular weight of 338.79 g/mol. Its IUPAC name is 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide.

Molecular Properties

Compound Name2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
PubChem CID6870033
Molecular FormulaC19H15ClN2O2
Molecular Weight338.79 g/mol
Exact Mass338.08
IUPAC Name2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
SMILESCOc1ccc(/C=N/NC(=O)c2ccccc2Cl)c2ccccc12
InChIInChI=1S/C19H15ClN2O2/c1-24-18-11-10-13(14-6-2-3-7-15(14)18)12-21-22-19(23)16-8-4-5-9-17(16)20/h2-12H,1H3,(H,22,23)/b21-12+
InChIKeyZKWXXONSVHWTMG-CIAFOILYSA-N
XLogP4.27
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.79
LogP ≤ 54.27
H-Bond Donors ≤ 51
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'}

Analyze 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
CID 5416523
3-methoxy-N-[(Z)-(4-methoxynaphthalen-1-yl)methylideneamino]naphthalene-2-carboxamide
CID 6044173
2-chloro-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]benzamide
CID 6871464
3-chloro-N-[(4-methoxynaphthalen-1-yl)methylideneamino]benzamide
CID 693396
N-[(4-methoxynaphthalen-1-yl)methylideneamino]-2-methylfuran-3-carboxamide
CID 932462
2-chloro-N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]benzamide
CID 5396822
2-(2-chlorophenoxy)-N-[(4-methoxynaphthalen-1-yl)methylideneamino]acetamide
CID 3361863
(2S)-2-[2-[(Z)-[(2-chlorobenzoyl)hydrazinylidene]methyl]-6-methoxyphenoxy]propanoic acid
CID 126239591
N-[(E)-(2-chloro-4,5-dimethoxyphenyl)methylideneamino]-2-methoxybenzamide
CID 54784673
N-[(4-methoxynaphthalen-1-yl)methylideneamino]pyridine-4-carboxamide
CID 904375
2-chloro-N-[(Z)-(3,5-dichloro-2,4-dimethoxyphenyl)methylideneamino]benzamide
CID 110509287
2-chloro-N-[(Z)-(3-chloro-4,5-dimethoxyphenyl)methylideneamino]benzamide
CID 9016258

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide?
The IUPAC name of 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide (CID 6870033) is 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide.
What is the SMILES notation for 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide?
The canonical SMILES for 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide is COc1ccc(/C=N/NC(=O)c2ccccc2Cl)c2ccccc12.
What is the InChIKey of 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide?
The InChIKey is ZKWXXONSVHWTMG-CIAFOILYSA-N. The full InChI is InChI=1S/C19H15ClN2O2/c1-24-18-11-10-13(14-6-2-3-7-15(14)18)12-21-22-19(23)16-8-4-5-9-17(16)20/h2-12H,1H3,(H,22,23)/b21-12+.
What are the key properties of 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide?
2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide has a molecular weight of 338.79 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]benzamide is sourced from PubChem (CID 6870033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).