N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine

C15H16N2 — CID 90830310

IUPACN-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine
SMILESC/C(=N\c1cc(C)cc(C)c1)c1cccnc1
InChIInChI=1S/C15H16N2/c1-11-7-12(2)9-15(8-11)17-13(3)14-5-4-6-16-10-14/h4-10H,1-3H3/b17-13+
InChIKeyOSVJYZNGDUCXSB-GHRIWEEISA-N
MW224.31 g/mol
LogP3.84
Rot. Bonds2

About N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine

N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine (PubChem CID 90830310) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine
PubChem CID90830310
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC NameN-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine
SMILESC/C(=N\c1cc(C)cc(C)c1)c1cccnc1
InChIInChI=1S/C15H16N2/c1-11-7-12(2)9-15(8-11)17-13(3)14-5-4-6-16-10-14/h4-10H,1-3H3/b17-13+
InChIKeyOSVJYZNGDUCXSB-GHRIWEEISA-N
XLogP3.84
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.84
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

N-(3,5-ditert-butylphenyl)-1-pyridin-3-ylethanimine
CID 87864246
(E)-1-pyridin-3-yl-N-[(E)-1-pyridin-3-ylethylideneamino]ethanimine
CID 5405316
N-(2-chloro-4,6-dimethylphenyl)-1-pyridin-3-ylethanimine;N-(2,6-dimethylphenyl)ethanimine;iron(3+);dichloride
CID 173135671
N-methoxy-1-pyridin-3-ylethanimine
CID 57395319
N-[2,6-di(propan-2-yl)phenyl]-1-pyridin-3-ylethanimine
CID 20639667
N-(4-icosoxy-3,5-diphenylphenyl)-1-pyridin-3-ylethanimine;iron
CID 87867411
(NE,R)-2-methyl-N-(1-pyridin-3-ylethylidene)propane-2-sulfinamide
CID 53247809
(Z)-1-pyridin-3-yl-N-(1,2,4-triazol-4-yl)ethanimine
CID 6081356
1-pyridin-3-ylethanethione
CID 11815891
1-(3-methylphenyl)-N-(3-methyl-4-pyridinyl)ethanimine
CID 143844840
1-pyridin-3-ylethanone;hydrochloride
CID 69233376
3-[(Z)-but-2-en-2-yl]pyridine
CID 101055092

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine?
The IUPAC name of N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine (CID 90830310) is N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine.
What is the SMILES notation for N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine?
The canonical SMILES for N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine is C/C(=N\c1cc(C)cc(C)c1)c1cccnc1.
What is the InChIKey of N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine?
The InChIKey is OSVJYZNGDUCXSB-GHRIWEEISA-N. The full InChI is InChI=1S/C15H16N2/c1-11-7-12(2)9-15(8-11)17-13(3)14-5-4-6-16-10-14/h4-10H,1-3H3/b17-13+.
What are the key properties of N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine?
N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine has a molecular weight of 224.31 g/mol, XLogP of 3.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-1-pyridin-3-ylethanimine is sourced from PubChem (CID 90830310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).