1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine

C17H19NO2 — CID 71354195

IUPAC1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine
SMILESCCCOc1ccc(/N=C/c2ccc(OC)cc2)cc1
InChIInChI=1S/C17H19NO2/c1-3-12-20-17-10-6-15(7-11-17)18-13-14-4-8-16(19-2)9-5-14/h4-11,13H,3,12H2,1-2H3/b18-13+
InChIKeyDHOBAWWYLDTYAH-QGOAFFKASA-N
MW269.34 g/mol
LogP4.23
Rot. Bonds6

About 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine

1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine (PubChem CID 71354195) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine
PubChem CID71354195
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine
SMILESCCCOc1ccc(/N=C/c2ccc(OC)cc2)cc1
InChIInChI=1S/C17H19NO2/c1-3-12-20-17-10-6-15(7-11-17)18-13-14-4-8-16(19-2)9-5-14/h4-11,13H,3,12H2,1-2H3/b18-13+
InChIKeyDHOBAWWYLDTYAH-QGOAFFKASA-N
XLogP4.23
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(4-methoxyphenyl)-N-(4-pentoxyphenyl)methanimine
CID 102149823
N-(4-hexoxyphenyl)-1-(4-methoxyphenyl)methanimine
CID 86094874
1-[4-[3-[4-[(4-methoxyphenyl)diazenyl]phenoxy]propoxy]phenyl]-N-[4-[5-[4-[[4-[3-[4-[(4-methoxyphenyl)diazenyl]phenoxy]propoxy]phenyl]methylideneamino]phenoxy]pentoxy]phenyl]methanimine
CID 101153259
N-(4-hexoxyphenyl)-1-[4-[(4-hexoxyphenyl)iminomethyl]phenyl]methanimine
CID 101374448
1-(4-ethoxyphenyl)-N-(4-pentoxyphenyl)methanimine
CID 71354191
1-(4-ethoxyphenyl)-N-(4-hexadecoxyphenyl)methanimine
CID 102390426
1-(4-butoxyphenyl)-N-(4-ethylphenyl)methanimine;ethane
CID 143730217
3-[4-[(4-propoxyphenyl)methylideneamino]benzoyl]oxypropyl 4-[(4-propoxyphenyl)methylideneamino]benzoate
CID 102594777
N-(4-ethylphenyl)-1-(4-hexadecoxyphenyl)methanimine
CID 2753474
1-(4-decoxyphenyl)-N-(4-ethenylphenyl)methanimine
CID 59991212
4-[(4-dodecoxyphenyl)methylideneamino]phenol
CID 18443748
methyl 2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]acetate
CID 94832083

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine?
The IUPAC name of 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine (CID 71354195) is 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine is CCCOc1ccc(/N=C/c2ccc(OC)cc2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine?
The InChIKey is DHOBAWWYLDTYAH-QGOAFFKASA-N. The full InChI is InChI=1S/C17H19NO2/c1-3-12-20-17-10-6-15(7-11-17)18-13-14-4-8-16(19-2)9-5-14/h4-11,13H,3,12H2,1-2H3/b18-13+.
What are the key properties of 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine?
1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine has a molecular weight of 269.34 g/mol, XLogP of 4.23, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-(4-propoxyphenyl)methanimine is sourced from PubChem (CID 71354195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).