2-(4-ethylmorpholin-2-yl)acetonitrile

C8H14N2O — CID 79164435

IUPAC2-(4-ethylmorpholin-2-yl)acetonitrile
SMILESCCN1CCOC(CC#N)C1
InChIInChI=1S/C8H14N2O/c1-2-10-5-6-11-8(7-10)3-4-9/h8H,2-3,5-7H2,1H3
InChIKeySSNDRYAKFABSLU-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.62
Rot. Bonds2

About 2-(4-ethylmorpholin-2-yl)acetonitrile

2-(4-ethylmorpholin-2-yl)acetonitrile (PubChem CID 79164435) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-(4-ethylmorpholin-2-yl)acetonitrile.

Molecular Properties

Compound Name2-(4-ethylmorpholin-2-yl)acetonitrile
PubChem CID79164435
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2-(4-ethylmorpholin-2-yl)acetonitrile
SMILESCCN1CCOC(CC#N)C1
InChIInChI=1S/C8H14N2O/c1-2-10-5-6-11-8(7-10)3-4-9/h8H,2-3,5-7H2,1H3
InChIKeySSNDRYAKFABSLU-UHFFFAOYSA-N
XLogP0.62
TPSA36.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-diethylmorpholine
CID 58988021
2-[(4-ethylmorpholin-2-yl)methyl-methylamino]acetonitrile
CID 78946650
4-ethyl-2-propylmorpholine
CID 127673597
3-[(4-ethylmorpholin-2-yl)methyl-methylamino]butanenitrile
CID 79164880
2-(4-propan-2-ylmorpholin-2-yl)acetonitrile
CID 64534117
2-(2-propylmorpholin-4-yl)acetonitrile
CID 130694336
1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidine-2-carbonitrile
CID 79165770
2-[1-[[(4-ethylmorpholin-2-yl)methylamino]methyl]cyclopropyl]acetonitrile
CID 114399825
2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]butanenitrile
CID 79165345
2-[(2S)-4-ethylmorpholin-2-yl]-N-methylethanamine
CID 94133449
2-[(3-chloropyrrolidin-1-yl)methyl]-4-ethylmorpholine
CID 79182491
2-[(4-ethylmorpholin-2-yl)methyl]-1,1-dimethylhydrazine
CID 83013622

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylmorpholin-2-yl)acetonitrile?
The IUPAC name of 2-(4-ethylmorpholin-2-yl)acetonitrile (CID 79164435) is 2-(4-ethylmorpholin-2-yl)acetonitrile.
What is the SMILES notation for 2-(4-ethylmorpholin-2-yl)acetonitrile?
The canonical SMILES for 2-(4-ethylmorpholin-2-yl)acetonitrile is CCN1CCOC(CC#N)C1.
What is the InChIKey of 2-(4-ethylmorpholin-2-yl)acetonitrile?
The InChIKey is SSNDRYAKFABSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-2-10-5-6-11-8(7-10)3-4-9/h8H,2-3,5-7H2,1H3.
What are the key properties of 2-(4-ethylmorpholin-2-yl)acetonitrile?
2-(4-ethylmorpholin-2-yl)acetonitrile has a molecular weight of 154.21 g/mol, XLogP of 0.62, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylmorpholin-2-yl)acetonitrile is sourced from PubChem (CID 79164435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).