N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine

C20H19NO3 — CID 23343935

IUPACN-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine
SMILESCOc1ccc(COc2ccc(/C=N/Cc3ccco3)cc2)cc1
InChIInChI=1S/C20H19NO3/c1-22-18-8-6-17(7-9-18)15-24-19-10-4-16(5-11-19)13-21-14-20-3-2-12-23-20/h2-13H,14-15H2,1H3/b21-13+
InChIKeyWBVCOFJFDRVARL-FYJGNVAPSA-N
MW321.38 g/mol
LogP4.49
Rot. Bonds7

About N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine

N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine (PubChem CID 23343935) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine
PubChem CID23343935
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC NameN-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine
SMILESCOc1ccc(COc2ccc(/C=N/Cc3ccco3)cc2)cc1
InChIInChI=1S/C20H19NO3/c1-22-18-8-6-17(7-9-18)15-24-19-10-4-16(5-11-19)13-21-14-20-3-2-12-23-20/h2-13H,14-15H2,1H3/b21-13+
InChIKeyWBVCOFJFDRVARL-FYJGNVAPSA-N
XLogP4.49
TPSA43.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 54.49
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-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
(Z)-N-[(Z)-furan-2-ylmethylideneamino]-1-(4-phenylmethoxyphenyl)methanimine
CID 6306571
N-methoxy-1-[4-[[4-(methoxymethyl)phenyl]methoxy]phenyl]methanimine
CID 57281154
N-ethyl-1-(4-methoxyphenyl)methanimine
CID 12927006
N-(furan-2-ylmethyl)-2-[4-[[[2-[(4-methoxyphenyl)methylsulfanyl]acetyl]hydrazinylidene]methyl]phenoxy]acetamide
CID 4027048
N-[(E)-(4-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide
CID 6880344
2,3-bis[[4-[(4-methoxyphenyl)methoxy]phenyl]methylidene]butanedial
CID 72968223
1-(furan-2-ylmethyl)-4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium
CID 4741925
N-(furan-2-ylmethyl)-1-(4-phenylmethoxyphenyl)methanamine;hydrochloride
CID 2995197
4-methoxy-N-[(4-phenylmethoxyphenyl)methylideneamino]benzamide
CID 584913
2-(4-methoxyphenoxy)-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]acetamide
CID 6386524
2-[4-(furan-2-ylmethoxy)phenyl]ethanamine
CID 65362318

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine?
The IUPAC name of N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine (CID 23343935) is N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine.
What is the SMILES notation for N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine?
The canonical SMILES for N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine is COc1ccc(COc2ccc(/C=N/Cc3ccco3)cc2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine?
The InChIKey is WBVCOFJFDRVARL-FYJGNVAPSA-N. The full InChI is InChI=1S/C20H19NO3/c1-22-18-8-6-17(7-9-18)15-24-19-10-4-16(5-11-19)13-21-14-20-3-2-12-23-20/h2-13H,14-15H2,1H3/b21-13+.
What are the key properties of N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine?
N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine has a molecular weight of 321.38 g/mol, XLogP of 4.49, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-1-[4-[(4-methoxyphenyl)methoxy]phenyl]methanimine is sourced from PubChem (CID 23343935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).