1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine

C21H21NO — CID 3549672

IUPAC1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine
SMILESCCOc1ccc2ccccc2c1/C=N/c1ccc(CC)cc1
InChIInChI=1S/C21H21NO/c1-3-16-9-12-18(13-10-16)22-15-20-19-8-6-5-7-17(19)11-14-21(20)23-4-2/h5-15H,3-4H2,1-2H3/b22-15+
InChIKeyRRSDPYSWFPYJNW-PXLXIMEGSA-N
MW303.41 g/mol
LogP5.55
Rot. Bonds5

About 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine

1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine (PubChem CID 3549672) has the molecular formula C21H21NO and a molecular weight of 303.41 g/mol. Its IUPAC name is 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine.

Molecular Properties

Compound Name1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine
PubChem CID3549672
Molecular FormulaC21H21NO
Molecular Weight303.41 g/mol
Exact Mass303.16
IUPAC Name1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine
SMILESCCOc1ccc2ccccc2c1/C=N/c1ccc(CC)cc1
InChIInChI=1S/C21H21NO/c1-3-16-9-12-18(13-10-16)22-15-20-19-8-6-5-7-17(19)11-14-21(20)23-4-2/h5-15H,3-4H2,1-2H3/b22-15+
InChIKeyRRSDPYSWFPYJNW-PXLXIMEGSA-N
XLogP5.55
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.41
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine 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-[(2-ethoxynaphthalen-1-yl)methylideneamino]benzenesulfonamide
CID 3940132
1-[2-[(4-bromophenyl)methoxy]naphthalen-1-yl]-N-phenylmethanimine
CID 126208478
N-(4-bromophenyl)-1-(2-phenylmethoxynaphthalen-1-yl)methanimine
CID 4779325
1-[2-(naphthalen-1-ylmethoxy)naphthalen-1-yl]-N-phenylmethanimine
CID 126215170
N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine
CID 110338371
N-(4-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)naphthalen-1-yl]methanimine
CID 126215977
N-(3-chloro-4-methylphenyl)-2-[1-[(4-ethylphenyl)iminomethyl]naphthalen-2-yl]oxyacetamide
CID 126217069
1-[3-ethoxy-5-iodo-4-(naphthalen-1-ylmethoxy)phenyl]-N-(4-ethylphenyl)methanimine
CID 126215352
1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine
CID 139088664
(Z)-1-(2-ethoxynaphthalen-1-yl)-N-(1,2,4-triazol-4-yl)methanimine
CID 7638517
2-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]guanidine
CID 71670095
N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-5-ethylpyridine-2-carboxamide
CID 6872223

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine?
The IUPAC name of 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine (CID 3549672) is 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine.
What is the SMILES notation for 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine?
The canonical SMILES for 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine is CCOc1ccc2ccccc2c1/C=N/c1ccc(CC)cc1.
What is the InChIKey of 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine?
The InChIKey is RRSDPYSWFPYJNW-PXLXIMEGSA-N. The full InChI is InChI=1S/C21H21NO/c1-3-16-9-12-18(13-10-16)22-15-20-19-8-6-5-7-17(19)11-14-21(20)23-4-2/h5-15H,3-4H2,1-2H3/b22-15+.
What are the key properties of 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine?
1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine has a molecular weight of 303.41 g/mol, XLogP of 5.55, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine is sourced from PubChem (CID 3549672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).