N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine

C23H24N2 — CID 142056339

IUPACN-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine
SMILESCCc1cccc(C(C)C)c1/N=C(\c1ccccc1)c1ccccn1
InChIInChI=1S/C23H24N2/c1-4-18-13-10-14-20(17(2)3)22(18)25-23(19-11-6-5-7-12-19)21-15-8-9-16-24-21/h5-17H,4H2,1-3H3/b25-23+
InChIKeyWKDASIHQCJFBOB-WJTDDFOZSA-N
MW328.46 g/mol
LogP5.94
Rot. Bonds5

About N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine

N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine (PubChem CID 142056339) has the molecular formula C23H24N2 and a molecular weight of 328.46 g/mol. Its IUPAC name is N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine.

Molecular Properties

Compound NameN-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine
PubChem CID142056339
Molecular FormulaC23H24N2
Molecular Weight328.46 g/mol
Exact Mass328.19
IUPAC NameN-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine
SMILESCCc1cccc(C(C)C)c1/N=C(\c1ccccc1)c1ccccn1
InChIInChI=1S/C23H24N2/c1-4-18-13-10-14-20(17(2)3)22(18)25-23(19-11-6-5-7-12-19)21-15-8-9-16-24-21/h5-17H,4H2,1-3H3/b25-23+
InChIKeyWKDASIHQCJFBOB-WJTDDFOZSA-N
XLogP5.94
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.46
LogP ≤ 55.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-phenyl-N-[4-[[4-[[phenyl(pyridin-2-yl)methylidene]amino]-3,5-di(propan-2-yl)phenyl]methyl]-2,6-di(propan-2-yl)phenyl]-1-pyridin-2-ylmethanimine
CID 101245464
N-[2,6-di(propan-2-yl)phenyl]-1-(1,10-phenanthrolin-2-yl)-1-phenylmethanimine
CID 11984252
N-(2-tert-butyl-6-propan-2-ylphenyl)-1-[6-[N-(2-tert-butyl-6-propan-2-ylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-1-phenylmethanimine
CID 90442403
N-(2,6-diethylphenyl)-1-pyridin-2-ylethanimine;nickel(2+)
CID 158562372
1-[6-[N-(2-chloro-6-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-N-(2-methyl-6-propan-2-ylphenyl)-1-phenylmethanimine;iron(2+);bis(triethyl(methanidyl)silane)
CID 162451139
2-N-(2,6-diethylphenyl)-3-N-[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine;nickel
CID 87861081
1-(3-bromophenyl)-N-[2,6-di(propan-2-yl)phenyl]-1-phenylmethanimine
CID 58238566
3-(2,6-diethylphenyl)imino-1-pyridin-2-ylbutan-1-one
CID 141062715
[2-[2,6-di(propan-2-yl)phenyl]imino-2-pyridin-2-ylethyl]-tris(2,3,4,5,6-pentafluorophenyl)boranuide
CID 177420335
1-phenyl-N-[(1R)-1-phenylethyl]-1-pyridin-2-ylmethanimine
CID 102238244
1-[6-[N-(2-chloro-6-methylphenyl)-C-phenylcarbonimidoyl]-2-pyridinyl]-N-(2-methyl-6-propan-2-ylphenyl)-1-phenylmethanimine;iron(2+);bis(methanidyl(trimethyl)silane)
CID 162451118
(NZ)-N-[phenyl(pyridin-2-yl)methylidene]hydroxylamine
CID 135427108

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine?
The IUPAC name of N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine (CID 142056339) is N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine.
What is the SMILES notation for N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine?
The canonical SMILES for N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine is CCc1cccc(C(C)C)c1/N=C(\c1ccccc1)c1ccccn1.
What is the InChIKey of N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine?
The InChIKey is WKDASIHQCJFBOB-WJTDDFOZSA-N. The full InChI is InChI=1S/C23H24N2/c1-4-18-13-10-14-20(17(2)3)22(18)25-23(19-11-6-5-7-12-19)21-15-8-9-16-24-21/h5-17H,4H2,1-3H3/b25-23+.
What are the key properties of N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine?
N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine has a molecular weight of 328.46 g/mol, XLogP of 5.94, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-propan-2-ylphenyl)-1-phenyl-1-pyridin-2-ylmethanimine is sourced from PubChem (CID 142056339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).