2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile

C14H19N3O — CID 60658562

IUPAC2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile
SMILESCc1cc(C)c(C#N)c(N2CC(C)OC(C)C2)n1
InChIInChI=1S/C14H19N3O/c1-9-5-10(2)16-14(13(9)6-15)17-7-11(3)18-12(4)8-17/h5,11-12H,7-8H2,1-4H3
InChIKeyHWADMAUYYNLHRR-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.18
Rot. Bonds1

About 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile

2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile (PubChem CID 60658562) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile
PubChem CID60658562
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile
SMILESCc1cc(C)c(C#N)c(N2CC(C)OC(C)C2)n1
InChIInChI=1S/C14H19N3O/c1-9-5-10(2)16-14(13(9)6-15)17-7-11(3)18-12(4)8-17/h5,11-12H,7-8H2,1-4H3
InChIKeyHWADMAUYYNLHRR-UHFFFAOYSA-N
XLogP2.18
TPSA49.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-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

Related Compounds

2-(azetidin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 130547075
(3S,4S)-1-(3-cyano-4,6-dimethyl-2-pyridinyl)-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 122064101
2-(3-hydroxypiperidin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 60658799
2-(3-ethyl-4-methylpiperazin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 63621643
2-(3-formylpiperidin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 55100699
4,6-dimethyl-2-(3-oxa-9-azaspiro[5.5]undecan-9-yl)pyridine-3-carbonitrile
CID 56916954
1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
CID 726811
2-(4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 81107513
2-(4-cyclopropylsulfonylpiperazin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 154883013
4,6-dimethyl-2-(4-propylpiperazin-1-yl)pyridine-3-carbonitrile
CID 60658707
2-(2,4-dimethylpiperidin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 55061903
4,6-dimethyl-2-[3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]pyridine-3-carbonitrile
CID 122137130

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile (CID 60658562) is 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile is Cc1cc(C)c(C#N)c(N2CC(C)OC(C)C2)n1.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile?
The InChIKey is HWADMAUYYNLHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-9-5-10(2)16-14(13(9)6-15)17-7-11(3)18-12(4)8-17/h5,11-12H,7-8H2,1-4H3.
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile?
2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile has a molecular weight of 245.33 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)-4,6-dimethylpyridine-3-carbonitrile is sourced from PubChem (CID 60658562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).