1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine

C25H27NO2 — CID 101216263

IUPAC1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine
SMILESCOc1cccc(OC)c1/C=N/c1ccccc1C(C)(C)Cc1ccccc1
InChIInChI=1S/C25H27NO2/c1-25(2,17-19-11-6-5-7-12-19)21-13-8-9-14-22(21)26-18-20-23(27-3)15-10-16-24(20)28-4/h5-16,18H,17H2,1-4H3/b26-18+
InChIKeyLSFDYIDSQSMDPZ-NLRVBDNBSA-N
MW373.50 g/mol
LogP5.97
Rot. Bonds7

About 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine

1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine (PubChem CID 101216263) has the molecular formula C25H27NO2 and a molecular weight of 373.50 g/mol. Its IUPAC name is 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine.

Molecular Properties

Compound Name1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine
PubChem CID101216263
Molecular FormulaC25H27NO2
Molecular Weight373.50 g/mol
Exact Mass373.20
IUPAC Name1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine
SMILESCOc1cccc(OC)c1/C=N/c1ccccc1C(C)(C)Cc1ccccc1
InChIInChI=1S/C25H27NO2/c1-25(2,17-19-11-6-5-7-12-19)21-13-8-9-14-22(21)26-18-20-23(27-3)15-10-16-24(20)28-4/h5-16,18H,17H2,1-4H3/b26-18+
InChIKeyLSFDYIDSQSMDPZ-NLRVBDNBSA-N
XLogP5.97
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.50
LogP ≤ 55.97
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-(2,6-dimethoxyphenyl)-N-[5-methoxy-2-[(E)-2,5,6-trimethylhept-4-en-2-yl]phenyl]methanimine
CID 11441228
chloropalladium(1+);1-(2,6-dimethoxyphenyl)-N-[2-(2-methanidylpropan-2-yl)-5-methoxyphenyl]methanimine
CID 11385813
4,6-ditert-butyl-3-[(2-methoxyphenyl)iminomethyl]benzene-1,2-diol
CID 138115656
1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine
CID 123655225
2-(2-methoxyphenyl)-4-phenylbutan-2-amine
CID 54918972
N-(2,3-dimethylphenyl)-1-(2-methoxynaphthalen-1-yl)methanimine
CID 126214700
2-benzyl-1,3-bis(2,6-dimethoxyphenyl)-2-phosphorosopropane-1,3-dione
CID 66688062
1-tert-butyl-4-[2-(2-ethoxyphenyl)-2-methylpropyl]-2-methoxybenzene
CID 126760949
1-(2,3-difluorophenyl)-2-(2-methoxyphenyl)propan-2-ol
CID 65144915
(2-methoxy-2-methylpropyl)benzene
CID 3842751
(E)-3-[2-(1,1-difluoroethyl)-6-methoxyphenyl]prop-2-en-1-amine
CID 117326640
1-(2,6-dichlorophenyl)-2-(2-methoxyphenyl)propan-2-ol
CID 65144676

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine?
The IUPAC name of 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine (CID 101216263) is 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine.
What is the SMILES notation for 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine?
The canonical SMILES for 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine is COc1cccc(OC)c1/C=N/c1ccccc1C(C)(C)Cc1ccccc1.
What is the InChIKey of 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine?
The InChIKey is LSFDYIDSQSMDPZ-NLRVBDNBSA-N. The full InChI is InChI=1S/C25H27NO2/c1-25(2,17-19-11-6-5-7-12-19)21-13-8-9-14-22(21)26-18-20-23(27-3)15-10-16-24(20)28-4/h5-16,18H,17H2,1-4H3/b26-18+.
What are the key properties of 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine?
1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine has a molecular weight of 373.50 g/mol, XLogP of 5.97, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethoxyphenyl)-N-[2-(2-methyl-1-phenylpropan-2-yl)phenyl]methanimine is sourced from PubChem (CID 101216263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).