4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile

C14H19N3O — CID 701914

IUPAC4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile
SMILESCOCc1cc(C)nc(N2CCCCC2)c1C#N
InChIInChI=1S/C14H19N3O/c1-11-8-12(10-18-2)13(9-15)14(16-11)17-6-4-3-5-7-17/h8H,3-7,10H2,1-2H3
InChIKeyKZOIEGZSQKTVBC-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.40
Rot. Bonds3

About 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile

4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile (PubChem CID 701914) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile.

Molecular Properties

Compound Name4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile
PubChem CID701914
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile
SMILESCOCc1cc(C)nc(N2CCCCC2)c1C#N
InChIInChI=1S/C14H19N3O/c1-11-8-12(10-18-2)13(9-15)14(16-11)17-6-4-3-5-7-17/h8H,3-7,10H2,1-2H3
InChIKeyKZOIEGZSQKTVBC-UHFFFAOYSA-N
XLogP2.40
TPSA49.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile?
The IUPAC name of 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile (CID 701914) is 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile.
What is the SMILES notation for 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile?
The canonical SMILES for 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile is COCc1cc(C)nc(N2CCCCC2)c1C#N.
What is the InChIKey of 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile?
The InChIKey is KZOIEGZSQKTVBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-11-8-12(10-18-2)13(9-15)14(16-11)17-6-4-3-5-7-17/h8H,3-7,10H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile?
4-(methoxymethyl)-6-methyl-2-piperidin-1-ylpyridine-3-carbonitrile has a molecular weight of 245.33 g/mol, XLogP of 2.40, 3 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-piperidin-1-ylpyridine-3-carbonitrile is sourced from PubChem (CID 701914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).