1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine

C23H23NO — CID 139088664

IUPAC1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine
SMILESCCOc1ccc2ccccc2c1/C=N/c1cccc2c1CCCC2
InChIInChI=1S/C23H23NO/c1-2-25-23-15-14-18-9-3-5-11-19(18)21(23)16-24-22-13-7-10-17-8-4-6-12-20(17)22/h3,5,7,9-11,13-16H,2,4,6,8,12H2,1H3/b24-16+
InChIKeyOFBJRKXFHXGHMK-LFVJCYFKSA-N
MW329.44 g/mol
LogP5.87
Rot. Bonds4

About 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine

1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine (PubChem CID 139088664) has the molecular formula C23H23NO and a molecular weight of 329.44 g/mol. Its IUPAC name is 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine.

Molecular Properties

Compound Name1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine
PubChem CID139088664
Molecular FormulaC23H23NO
Molecular Weight329.44 g/mol
Exact Mass329.18
IUPAC Name1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine
SMILESCCOc1ccc2ccccc2c1/C=N/c1cccc2c1CCCC2
InChIInChI=1S/C23H23NO/c1-2-25-23-15-14-18-9-3-5-11-19(18)21(23)16-24-22-13-7-10-17-8-4-6-12-20(17)22/h3,5,7,9-11,13-16H,2,4,6,8,12H2,1H3/b24-16+
InChIKeyOFBJRKXFHXGHMK-LFVJCYFKSA-N
XLogP5.87
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.44
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxy-6-(5,6,7,8-tetrahydronaphthalen-1-yliminomethyl)phenol
CID 135657451
1-(2-ethoxynaphthalen-1-yl)-N-(4-ethylphenyl)methanimine
CID 3549672
N-(2,3-dimethylphenyl)-1-(2-methoxynaphthalen-1-yl)methanimine
CID 126214700
N-[(E)-(2-ethoxynaphthalen-1-yl)methylideneamino]-N-methylmethanamine
CID 110338371
1-(2,6-dimethylphenyl)-N-naphthalen-1-ylmethanimine
CID 71530075
4-[(2-ethoxynaphthalen-1-yl)methylideneamino]benzenesulfonamide
CID 3940132
(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
CID 89247177
CID 89247177
2-[(1-bromo-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]-N-[(Z)-(2-methoxynaphthalen-1-yl)methylideneamino]acetamide
CID 6183485
2-[1-[(5-chloro-2-methylphenyl)iminomethyl]naphthalen-2-yl]oxyacetic acid
CID 126209756
N-(2,4-dimethylphenyl)-1-(2-methoxynaphthalen-1-yl)methanimine
CID 1272184

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine?
The IUPAC name of 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine (CID 139088664) is 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine.
What is the SMILES notation for 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine?
The canonical SMILES for 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine is CCOc1ccc2ccccc2c1/C=N/c1cccc2c1CCCC2.
What is the InChIKey of 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine?
The InChIKey is OFBJRKXFHXGHMK-LFVJCYFKSA-N. The full InChI is InChI=1S/C23H23NO/c1-2-25-23-15-14-18-9-3-5-11-19(18)21(23)16-24-22-13-7-10-17-8-4-6-12-20(17)22/h3,5,7,9-11,13-16H,2,4,6,8,12H2,1H3/b24-16+.
What are the key properties of 1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine?
1-(2-ethoxynaphthalen-1-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine has a molecular weight of 329.44 g/mol, XLogP of 5.87, 4 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-(5,6,7,8-tetrahydronaphthalen-1-yl)methanimine is sourced from PubChem (CID 139088664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).