1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine

C18H20N2O4S — CID 3494713

IUPAC1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine
SMILESCOc1ccc(/C=N/c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C18H20N2O4S/c1-23-17-6-2-15(3-7-17)14-19-16-4-8-18(9-5-16)25(21,22)20-10-12-24-13-11-20/h2-9,14H,10-13H2,1H3/b19-14+
InChIKeyLOGAGBRJETUIJL-XMHGGMMESA-N
MW360.44 g/mol
LogP2.47
Rot. Bonds5

About 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine

1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine (PubChem CID 3494713) has the molecular formula C18H20N2O4S and a molecular weight of 360.44 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine
PubChem CID3494713
Molecular FormulaC18H20N2O4S
Molecular Weight360.44 g/mol
Exact Mass360.11
IUPAC Name1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine
SMILESCOc1ccc(/C=N/c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C18H20N2O4S/c1-23-17-6-2-15(3-7-17)14-19-16-4-8-18(9-5-16)25(21,22)20-10-12-24-13-11-20/h2-9,14H,10-13H2,1H3/b19-14+
InChIKeyLOGAGBRJETUIJL-XMHGGMMESA-N
XLogP2.47
TPSA68.20 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(azepan-1-ylsulfonyl)phenyl]-1-(4-methoxyphenyl)methanimine
CID 4511187
N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylmethanimine
CID 968608
2-methoxy-4-[(4-morpholin-4-ylsulfonylphenyl)iminomethyl]phenol
CID 5155606
N-(4-morpholin-4-ylsulfonylphenyl)-1-[3-[(4-morpholin-4-ylsulfonylphenyl)iminomethyl]phenyl]methanimine
CID 4105745
1-(2-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine
CID 5155615
N-[(4-methoxyphenyl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline
CID 5059307
5-ethoxy-2-[(4-morpholin-4-ylsulfonylphenyl)iminomethyl]phenol
CID 135812287
1-(4-chlorophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)methanimine
CID 969315
4-methoxy-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]benzenesulfonamide
CID 28563195
N-(2-methoxy-4-morpholin-4-ylsulfonylphenyl)-1-pyridin-4-ylmethanimine
CID 23763226
N,3-bis(4-methoxyphenyl)-4-(4-morpholin-4-ylsulfonylphenyl)-1,3-thiazol-2-imine
CID 18812771
4-(4-ethenylphenyl)sulfonylmorpholine
CID 175115555

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine?
The IUPAC name of 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine (CID 3494713) is 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine is COc1ccc(/C=N/c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine?
The InChIKey is LOGAGBRJETUIJL-XMHGGMMESA-N. The full InChI is InChI=1S/C18H20N2O4S/c1-23-17-6-2-15(3-7-17)14-19-16-4-8-18(9-5-16)25(21,22)20-10-12-24-13-11-20/h2-9,14H,10-13H2,1H3/b19-14+.
What are the key properties of 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine?
1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine has a molecular weight of 360.44 g/mol, XLogP of 2.47, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)methanimine is sourced from PubChem (CID 3494713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).