4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile

C14H12N2O — CID 62935721

IUPAC4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile
SMILESCc1cccc(Oc2ccnc(C#N)c2)c1C
InChIInChI=1S/C14H12N2O/c1-10-4-3-5-14(11(10)2)17-13-6-7-16-12(8-13)9-15/h3-8H,1-2H3
InChIKeyVEUYVGJFCABQJV-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.36
Rot. Bonds2

About 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile

4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile (PubChem CID 62935721) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile
PubChem CID62935721
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile
SMILESCc1cccc(Oc2ccnc(C#N)c2)c1C
InChIInChI=1S/C14H12N2O/c1-10-4-3-5-14(11(10)2)17-13-6-7-16-12(8-13)9-15/h3-8H,1-2H3
InChIKeyVEUYVGJFCABQJV-UHFFFAOYSA-N
XLogP3.36
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-methyl-2-nitrophenoxy)pyridine-2-carbonitrile
CID 55155911
4-(5-fluoro-2-methylphenoxy)pyridine-2-carbonitrile
CID 102981648
4-(2-fluorophenoxy)pyridine-2-carbonitrile
CID 62936070
4-(4-chloro-3-methylphenoxy)pyridine-2-carbonitrile
CID 62937631
4-(4-amino-3-methylphenoxy)pyridine-2-carbonitrile
CID 55156270
4-[(5-methyl-1H-pyrazol-3-yl)oxy]pyridine-2-carbonitrile
CID 81341566
4-(2-amino-4-bromo-6-methylphenoxy)pyridine-2-carbonitrile
CID 79843917
4-(2-tert-butyl-4-ethylphenoxy)pyridine-2-carbonitrile
CID 63510038
4-(2,3-dimethylphenoxy)-2-methoxyaniline
CID 63677998
5-(3-amino-2-methylphenoxy)pyridine-2-carbonitrile
CID 113321408
4-(3-amino-2-methylphenoxy)-2-methylbenzonitrile
CID 81279070
4-(4-methoxy-3-nitrophenoxy)pyridine-2-carbonitrile
CID 103201670

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile?
The IUPAC name of 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile (CID 62935721) is 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile.
What is the SMILES notation for 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile?
The canonical SMILES for 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile is Cc1cccc(Oc2ccnc(C#N)c2)c1C.
What is the InChIKey of 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile?
The InChIKey is VEUYVGJFCABQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-10-4-3-5-14(11(10)2)17-13-6-7-16-12(8-13)9-15/h3-8H,1-2H3.
What are the key properties of 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile?
4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile has a molecular weight of 224.26 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylphenoxy)pyridine-2-carbonitrile is sourced from PubChem (CID 62935721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).