2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile

C14H20N4O — CID 56869919

IUPAC2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile
SMILESCN(C)CCC1CN(c2ncccc2C#N)CCO1
InChIInChI=1S/C14H20N4O/c1-17(2)7-5-13-11-18(8-9-19-13)14-12(10-15)4-3-6-16-14/h3-4,6,13H,5,7-9,11H2,1-2H3
InChIKeyUMVUCLOSDHITDF-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.11
Rot. Bonds4

About 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile

2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile (PubChem CID 56869919) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile
PubChem CID56869919
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile
SMILESCN(C)CCC1CN(c2ncccc2C#N)CCO1
InChIInChI=1S/C14H20N4O/c1-17(2)7-5-13-11-18(8-9-19-13)14-12(10-15)4-3-6-16-14/h3-4,6,13H,5,7-9,11H2,1-2H3
InChIKeyUMVUCLOSDHITDF-UHFFFAOYSA-N
XLogP1.11
TPSA52.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2S)-2-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]morpholin-4-yl]pyridine-3-carbonitrile
CID 95764314
2-[(3R)-3-[methyl(pyrimidin-2-ylmethyl)amino]pyrrolidin-1-yl]pyridine-3-carbonitrile
CID 129476892
2-[(3S)-3-methylpiperazin-1-yl]pyridine-3-carbonitrile
CID 58826334
2-[3-[methyl-(4-morpholin-4-ylpyrimidin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 171994800
2-(6-cyclobutyl-1,4-oxazepan-4-yl)pyridine-3-carbonitrile
CID 166225727
2-(2-ethylmorpholin-4-yl)benzonitrile
CID 43429873
2-[3-(methoxymethyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 113235312
2-(3-ethylpiperazin-1-yl)pyridine-3-carbonitrile
CID 167849231
2-(3-azabicyclo[4.1.0]heptan-3-yl)pyridine-3-carbonitrile
CID 117045417
[2-(2-ethylmorpholin-4-yl)-3-pyridinyl]methanol
CID 55031188
3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile
CID 71996195
N-[2-[1-(3-cyano-2-pyridinyl)piperidin-3-yl]ethyl]-N-(oxan-4-yl)formamide
CID 143229666

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile?
The IUPAC name of 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile (CID 56869919) is 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile?
The canonical SMILES for 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile is CN(C)CCC1CN(c2ncccc2C#N)CCO1.
What is the InChIKey of 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile?
The InChIKey is UMVUCLOSDHITDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-17(2)7-5-13-11-18(8-9-19-13)14-12(10-15)4-3-6-16-14/h3-4,6,13H,5,7-9,11H2,1-2H3.
What are the key properties of 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile?
2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile has a molecular weight of 260.34 g/mol, XLogP of 1.11, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(dimethylamino)ethyl]morpholin-4-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 56869919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).