N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine

C20H23N3 — CID 144876114

IUPACN-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine
SMILESC=NC.Cc1cc(C2=CN(C)CC=C2)cc(-c2cccnc2)c1
InChIInChI=1S/C18H18N2.C2H5N/c1-14-9-17(15-5-3-7-19-12-15)11-18(10-14)16-6-4-8-20(2)13-16;1-3-2/h3-7,9-13H,8H2,1-2H3;1H2,2H3
InChIKeyUKCMYJJMZJGTTR-UHFFFAOYSA-N
MW305.43 g/mol
LogP4.22
Rot. Bonds2

About N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine

N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine (PubChem CID 144876114) has the molecular formula C20H23N3 and a molecular weight of 305.43 g/mol. Its IUPAC name is N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine.

Molecular Properties

Compound NameN-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine
PubChem CID144876114
Molecular FormulaC20H23N3
Molecular Weight305.43 g/mol
Exact Mass305.19
IUPAC NameN-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine
SMILESC=NC.Cc1cc(C2=CN(C)CC=C2)cc(-c2cccnc2)c1
InChIInChI=1S/C18H18N2.C2H5N/c1-14-9-17(15-5-3-7-19-12-15)11-18(10-14)16-6-4-8-20(2)13-16;1-3-2/h3-7,9-13H,8H2,1-2H3;1H2,2H3
InChIKeyUKCMYJJMZJGTTR-UHFFFAOYSA-N
XLogP4.22
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 54.22
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

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3-[3-[(2S)-2-iodo-2-methyl-3H-pyridin-5-yl]-5-pyridin-3-ylphenyl]-5-methylpyridine
CID 70667052
3-[4-[3-[4-(1,2-dihydropyridin-5-yl)phenyl]-5-(4-pyridin-3-ylphenyl)phenyl]phenyl]pyridine
CID 118673055
3-[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine;propane
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CID 144553782
3-(4-methylcyclohepta-1,3,6-trien-1-yl)pyridine
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3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine
CID 46316443

Frequently Asked Questions

What is the IUPAC name of N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine?
The IUPAC name of N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine (CID 144876114) is N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine.
What is the SMILES notation for N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine?
The canonical SMILES for N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine is C=NC.Cc1cc(C2=CN(C)CC=C2)cc(-c2cccnc2)c1.
What is the InChIKey of N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine?
The InChIKey is UKCMYJJMZJGTTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2.C2H5N/c1-14-9-17(15-5-3-7-19-12-15)11-18(10-14)16-6-4-8-20(2)13-16;1-3-2/h3-7,9-13H,8H2,1-2H3;1H2,2H3.
What are the key properties of N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine?
N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine has a molecular weight of 305.43 g/mol, XLogP of 4.22, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanimine;3-[3-methyl-5-(1-methyl-2H-pyridin-5-yl)phenyl]pyridine is sourced from PubChem (CID 144876114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).