1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine

C24H18ClNO — CID 126206998

IUPAC1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine
SMILESClc1cc(/C=N/c2ccccc2)ccc1OCc1cccc2ccccc12
InChIInChI=1S/C24H18ClNO/c25-23-15-18(16-26-21-10-2-1-3-11-21)13-14-24(23)27-17-20-9-6-8-19-7-4-5-12-22(19)20/h1-16H,17H2/b26-16+
InChIKeyJILYJTPUXONMDI-WGOQTCKBSA-N
MW371.87 g/mol
LogP6.82
Rot. Bonds5

About 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine

1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine (PubChem CID 126206998) has the molecular formula C24H18ClNO and a molecular weight of 371.87 g/mol. Its IUPAC name is 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine.

Molecular Properties

Compound Name1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine
PubChem CID126206998
Molecular FormulaC24H18ClNO
Molecular Weight371.87 g/mol
Exact Mass371.11
IUPAC Name1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine
SMILESClc1cc(/C=N/c2ccccc2)ccc1OCc1cccc2ccccc12
InChIInChI=1S/C24H18ClNO/c25-23-15-18(16-26-21-10-2-1-3-11-21)13-14-24(23)27-17-20-9-6-8-19-7-4-5-12-22(19)20/h1-16H,17H2/b26-16+
InChIKeyJILYJTPUXONMDI-WGOQTCKBSA-N
XLogP6.82
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.87
LogP ≤ 56.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine 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

1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-(4-phenoxyphenyl)methanimine
CID 126222826
1-[3-chloro-4-[(2-chlorophenyl)methoxy]phenyl]-N-phenylmethanimine
CID 126222259
N-(3-chloro-2-methylphenyl)-1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]methanimine
CID 126217246
1-[2-(naphthalen-1-ylmethoxy)naphthalen-1-yl]-N-phenylmethanimine
CID 126215170
1-[3-chloro-5-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]-N-(4-methylphenyl)methanimine
CID 126217219
1-[3-bromo-4-(naphthalen-1-ylmethoxy)phenyl]-N-(3-chloro-2-methylphenyl)methanimine
CID 126219557
N'-[(Z)-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-N-ethyloxamide
CID 8931011
(NZ)-N-[[3-bromo-4-(naphthalen-1-ylmethoxy)phenyl]methylidene]hydroxylamine
CID 6242891
1-[[4-(bromomethyl)-2-chlorophenoxy]methyl]naphthalene
CID 63534211
N-[(E)-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-3-methoxy-4-phenylmethoxybenzamide
CID 126320496
1-[3-bromo-4-[(3-chlorophenyl)methoxy]phenyl]-N-phenylmethanimine
CID 126210174
1-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]-N-(4-morpholin-4-ylphenyl)methanimine
CID 1275998

Frequently Asked Questions

What is the IUPAC name of 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine?
The IUPAC name of 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine (CID 126206998) is 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine.
What is the SMILES notation for 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine?
The canonical SMILES for 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine is Clc1cc(/C=N/c2ccccc2)ccc1OCc1cccc2ccccc12.
What is the InChIKey of 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine?
The InChIKey is JILYJTPUXONMDI-WGOQTCKBSA-N. The full InChI is InChI=1S/C24H18ClNO/c25-23-15-18(16-26-21-10-2-1-3-11-21)13-14-24(23)27-17-20-9-6-8-19-7-4-5-12-22(19)20/h1-16H,17H2/b26-16+.
What are the key properties of 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine?
1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine has a molecular weight of 371.87 g/mol, XLogP of 6.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]-N-phenylmethanimine is sourced from PubChem (CID 126206998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).