4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile

C15H14N2O2 — CID 709284

IUPAC4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile
SMILESCOCc1cc(C)nc(Oc2ccccc2)c1C#N
InChIInChI=1S/C15H14N2O2/c1-11-8-12(10-18-2)14(9-16)15(17-11)19-13-6-4-3-5-7-13/h3-8H,10H2,1-2H3
InChIKeyMNTZTRGRWFUXJX-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.20
Rot. Bonds4

About 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile

4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile (PubChem CID 709284) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile.

Molecular Properties

Compound Name4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile
PubChem CID709284
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile
SMILESCOCc1cc(C)nc(Oc2ccccc2)c1C#N
InChIInChI=1S/C15H14N2O2/c1-11-8-12(10-18-2)14(9-16)15(17-11)19-13-6-4-3-5-7-13/h3-8H,10H2,1-2H3
InChIKeyMNTZTRGRWFUXJX-UHFFFAOYSA-N
XLogP3.20
TPSA55.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile?
The IUPAC name of 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile (CID 709284) is 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile.
What is the SMILES notation for 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile?
The canonical SMILES for 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile is COCc1cc(C)nc(Oc2ccccc2)c1C#N.
What is the InChIKey of 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile?
The InChIKey is MNTZTRGRWFUXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-11-8-12(10-18-2)14(9-16)15(17-11)19-13-6-4-3-5-7-13/h3-8H,10H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile?
4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile has a molecular weight of 254.29 g/mol, XLogP of 3.20, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-6-methyl-2-phenoxypyridine-3-carbonitrile is sourced from PubChem (CID 709284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).