2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide

C8H15N3O2 — CID 55137484

IUPAC2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide
SMILESCOCCN(CCC#N)CC(N)=O
InChIInChI=1S/C8H15N3O2/c1-13-6-5-11(4-2-3-9)7-8(10)12/h2,4-7H2,1H3,(H2,10,12)
InChIKeyZIVYAXOYPWMQLX-UHFFFAOYSA-N
MW185.23 g/mol
LogP-0.67
Rot. Bonds7

About 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide

2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide (PubChem CID 55137484) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide.

Molecular Properties

Compound Name2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide
PubChem CID55137484
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide
SMILESCOCCN(CCC#N)CC(N)=O
InChIInChI=1S/C8H15N3O2/c1-13-6-5-11(4-2-3-9)7-8(10)12/h2,4-7H2,1H3,(H2,10,12)
InChIKeyZIVYAXOYPWMQLX-UHFFFAOYSA-N
XLogP-0.67
TPSA79.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[bis(2-methoxyethyl)amino]-N-(2-cyanoethyl)-N-methylacetamide
CID 60672925
N-(2-cyanoethyl)-2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide
CID 63286365
propan-2-yl 2-[2-cyanoethyl(2-methoxyethyl)amino]acetate
CID 63285599
3-[2-methoxyethyl(2-methylprop-2-enyl)amino]propanenitrile
CID 63286745
2-[2-cyanoethyl(2-methoxyethyl)amino]-N-prop-2-ynylacetamide
CID 63286666
1-(2-cyanoethyl)-1-(2-methoxyethyl)urea
CID 63285915
3-[ethyl(2-methoxyethyl)amino]propanenitrile
CID 61448271
3-[2,3-dichloroprop-2-enyl(2-methoxyethyl)amino]propanenitrile
CID 79167562
methyl 4-[2-cyanoethyl(2-methoxyethyl)amino]butanoate
CID 63285080
3-[[2-(4-iodophenyl)-2-oxoethyl]-(2-methoxyethyl)amino]propanenitrile
CID 63285257
3-[2-methoxyethyl(2-oxoethyl)amino]propanenitrile
CID 63285436
2-bromo-N-(2-cyanoethyl)-N-(2-methoxyethyl)acetamide
CID 63681268

Frequently Asked Questions

What is the IUPAC name of 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide?
The IUPAC name of 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide (CID 55137484) is 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide.
What is the SMILES notation for 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide?
The canonical SMILES for 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide is COCCN(CCC#N)CC(N)=O.
What is the InChIKey of 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide?
The InChIKey is ZIVYAXOYPWMQLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-13-6-5-11(4-2-3-9)7-8(10)12/h2,4-7H2,1H3,(H2,10,12).
What are the key properties of 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide?
2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide has a molecular weight of 185.23 g/mol, XLogP of -0.67, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-cyanoethyl(2-methoxyethyl)amino]acetamide is sourced from PubChem (CID 55137484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).