N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine

C22H21NO2 — CID 163625272

IUPACN-[bis(4-methoxyphenyl)-phenylmethyl]methanimine
SMILESC=NC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1
InChIInChI=1S/C22H21NO2/c1-23-22(17-7-5-4-6-8-17,18-9-13-20(24-2)14-10-18)19-11-15-21(25-3)16-12-19/h4-16H,1H2,2-3H3
InChIKeyHRMBXLZRAWOAAW-UHFFFAOYSA-N
MW331.42 g/mol
LogP4.70
Rot. Bonds6

About N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine

N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine (PubChem CID 163625272) has the molecular formula C22H21NO2 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine.

Molecular Properties

Compound NameN-[bis(4-methoxyphenyl)-phenylmethyl]methanimine
PubChem CID163625272
Molecular FormulaC22H21NO2
Molecular Weight331.42 g/mol
Exact Mass331.16
IUPAC NameN-[bis(4-methoxyphenyl)-phenylmethyl]methanimine
SMILESC=NC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1
InChIInChI=1S/C22H21NO2/c1-23-22(17-7-5-4-6-8-17,18-9-13-20(24-2)14-10-18)19-11-15-21(25-3)16-12-19/h4-16H,1H2,2-3H3
InChIKeyHRMBXLZRAWOAAW-UHFFFAOYSA-N
XLogP4.70
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-4-[nitroso(diphenyl)methyl]benzene
CID 88893098
1-(4-methoxyphenyl)-1,2,2-triphenylethane-1,2-diol
CID 70611668
(4-methoxyphenyl)-diphenylmethanamine
CID 21477757
[bis(4-methoxyphenyl)-phenylmethyl]-λ2-stannane
CID 174814552
methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene
CID 158331426
(1S)-1-(4-methoxyphenyl)-1-phenylethanamine
CID 93047943
2-(4-methoxyphenyl)-2-phenylpropanenitrile
CID 175950796
1-methoxy-4-[4-(2-phenylpropan-2-yl)phenoxy]benzene
CID 175430407
1-hydroxy-1-(4-methoxyphenyl)-1-phenylpropan-2-one
CID 141100176
1-methoxy-4-[[(4-methoxyphenyl)-diphenylmethyl]sulfanyloxysulfanyl-diphenylmethyl]benzene
CID 66864456
(2R)-2-(4-methoxyphenyl)-3-methyl-2-phenylbutanenitrile
CID 134956914
N-(4-methoxyphenyl)-2,2,2-triphenylethanimine
CID 10872538

Frequently Asked Questions

What is the IUPAC name of N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine?
The IUPAC name of N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine (CID 163625272) is N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine.
What is the SMILES notation for N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine?
The canonical SMILES for N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine is C=NC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1.
What is the InChIKey of N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine?
The InChIKey is HRMBXLZRAWOAAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO2/c1-23-22(17-7-5-4-6-8-17,18-9-13-20(24-2)14-10-18)19-11-15-21(25-3)16-12-19/h4-16H,1H2,2-3H3.
What are the key properties of N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine?
N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine has a molecular weight of 331.42 g/mol, XLogP of 4.70, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(4-methoxyphenyl)-phenylmethyl]methanimine is sourced from PubChem (CID 163625272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).