2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide

C24H21ClN2O2 — CID 5203268

IUPAC2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide
SMILESO=C(NN=C1CCCc2ccccc21)c1ccccc1OCc1ccccc1Cl
InChIInChI=1S/C24H21ClN2O2/c25-21-13-5-2-9-18(21)16-29-23-15-6-4-12-20(23)24(28)27-26-22-14-7-10-17-8-1-3-11-19(17)22/h1-6,8-9,11-13,15H,7,10,14,16H2,(H,27,28)
InChIKeyICAOCTITVWRMEW-UHFFFAOYSA-N
MW404.90 g/mol
LogP5.39
Rot. Bonds5

About 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide

2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide (PubChem CID 5203268) has the molecular formula C24H21ClN2O2 and a molecular weight of 404.90 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide
PubChem CID5203268
Molecular FormulaC24H21ClN2O2
Molecular Weight404.90 g/mol
Exact Mass404.13
IUPAC Name2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide
SMILESO=C(NN=C1CCCc2ccccc21)c1ccccc1OCc1ccccc1Cl
InChIInChI=1S/C24H21ClN2O2/c25-21-13-5-2-9-18(21)16-29-23-15-6-4-12-20(23)24(28)27-26-22-14-7-10-17-8-1-3-11-19(17)22/h1-6,8-9,11-13,15H,7,10,14,16H2,(H,27,28)
InChIKeyICAOCTITVWRMEW-UHFFFAOYSA-N
XLogP5.39
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.90
LogP ≤ 55.39
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'}

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Related Compounds

2-[(2-chlorophenyl)methoxy]-N-[(Z)-2,3-dihydroinden-1-ylideneamino]benzamide
CID 6536600
2-[(2-chlorophenyl)methoxy]-N-[(E)-2,3-dihydroinden-1-ylideneamino]benzamide
CID 6310157
2-[(2-chlorophenyl)methoxy]-N-(2,3-dihydroinden-1-ylideneamino)benzamide
CID 5237892
2-chloro-N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]benzamide
CID 6536301
2-[(2-chlorophenyl)methoxy]-N-(fluoren-9-ylideneamino)benzamide
CID 2367127
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxybenzamide
CID 4999116
N-(2,3-dihydroinden-1-ylideneamino)-2-[(4-fluorophenyl)methoxy]benzamide
CID 5237889
2-bromo-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide
CID 3411206
2-[(2-chlorophenyl)methoxy]-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide
CID 135833052
2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
CID 26901785
2-[(2-chlorophenyl)methoxy]-N-(furan-2-ylmethylideneamino)benzamide
CID 2574555
2-[(2-chlorophenyl)methoxy]-N-(1H-pyrrol-2-ylmethylideneamino)benzamide
CID 2477343

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide?
The IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide (CID 5203268) is 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide?
The canonical SMILES for 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide is O=C(NN=C1CCCc2ccccc21)c1ccccc1OCc1ccccc1Cl.
What is the InChIKey of 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide?
The InChIKey is ICAOCTITVWRMEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21ClN2O2/c25-21-13-5-2-9-18(21)16-29-23-15-6-4-12-20(23)24(28)27-26-22-14-7-10-17-8-1-3-11-19(17)22/h1-6,8-9,11-13,15H,7,10,14,16H2,(H,27,28).
What are the key properties of 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide?
2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide has a molecular weight of 404.90 g/mol, XLogP of 5.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methoxy]-N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)benzamide is sourced from PubChem (CID 5203268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).