N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine

C16H17NO3 — CID 5201061

IUPACN-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/C=N/c2cc(OC)ccc2OC)cc1
InChIInChI=1S/C16H17NO3/c1-18-13-6-4-12(5-7-13)11-17-15-10-14(19-2)8-9-16(15)20-3/h4-11H,1-3H3/b17-11+
InChIKeyQGUUGOYYZBCCLH-GZTJUZNOSA-N
MW271.32 g/mol
LogP3.46
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine

N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine (PubChem CID 5201061) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine
PubChem CID5201061
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/C=N/c2cc(OC)ccc2OC)cc1
InChIInChI=1S/C16H17NO3/c1-18-13-6-4-12(5-7-13)11-17-15-10-14(19-2)8-9-16(15)20-3/h4-11H,1-3H3/b17-11+
InChIKeyQGUUGOYYZBCCLH-GZTJUZNOSA-N
XLogP3.46
TPSA40.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(4-chlorophenyl)-N-(2,4-dimethoxyphenyl)methanimine
CID 91664646
methyl 5-[(2,5-dimethoxyphenyl)iminomethyl]-2-hydroxybenzoate
CID 135524534
1-(2-chloro-1,3-thiazol-5-yl)-N-(2,5-dimethoxyphenyl)methanimine
CID 155676643
2-[(2,5-dimethoxyphenyl)iminomethyl]-6-methoxyphenol
CID 135595493
4-bromo-2-[(2,5-dimethoxyphenyl)iminomethyl]-6-methoxyphenol
CID 135592582
N-(2,5-dimethoxyphenyl)-3-(4-nitrophenyl)prop-2-en-1-imine
CID 4102744
1-(4-methoxyphenyl)-N-[3-[(4-methoxyphenyl)methylideneamino]phenyl]methanimine
CID 18527961
2,4-dichloro-6-[(2,5-dimethoxyphenyl)iminomethyl]phenol
CID 710294
4-[(5-amino-2-methoxyphenyl)iminomethyl]benzonitrile
CID 2354568
1-(6-methoxynaphthalen-2-yl)-N-(3,4,5-trimethoxyphenyl)methanimine
CID 50905580
1-(4-methoxyphenyl)-N-[2-[2-[2-[(4-methoxyphenyl)methylideneamino]phenyl]ethyl]phenyl]methanimine
CID 71317432
2-[(2,5-dimethoxyphenyl)iminomethyl]-3-hydroxyinden-1-one
CID 135432540

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine?
The IUPAC name of N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine (CID 5201061) is N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine is COc1ccc(/C=N/c2cc(OC)ccc2OC)cc1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine?
The InChIKey is QGUUGOYYZBCCLH-GZTJUZNOSA-N. The full InChI is InChI=1S/C16H17NO3/c1-18-13-6-4-12(5-7-13)11-17-15-10-14(19-2)8-9-16(15)20-3/h4-11H,1-3H3/b17-11+.
What are the key properties of N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine?
N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine has a molecular weight of 271.32 g/mol, XLogP of 3.46, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine is sourced from PubChem (CID 5201061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).