2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide

C14H19N3O2 — CID 82937600

IUPAC2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide
SMILESCC(CN(C)C)NC(=O)COc1ccccc1C#N
InChIInChI=1S/C14H19N3O2/c1-11(9-17(2)3)16-14(18)10-19-13-7-5-4-6-12(13)8-15/h4-7,11H,9-10H2,1-3H3,(H,16,18)
InChIKeyYGMYJKIMTKZVHY-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.00
Rot. Bonds6

About 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide

2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide (PubChem CID 82937600) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide
PubChem CID82937600
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide
SMILESCC(CN(C)C)NC(=O)COc1ccccc1C#N
InChIInChI=1S/C14H19N3O2/c1-11(9-17(2)3)16-14(18)10-19-13-7-5-4-6-12(13)8-15/h4-7,11H,9-10H2,1-3H3,(H,16,18)
InChIKeyYGMYJKIMTKZVHY-UHFFFAOYSA-N
XLogP1.00
TPSA65.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-cyanophenoxy)-N-(1-methoxypropan-2-yl)acetamide
CID 24691899
2-(2-cyanophenoxy)-N-(1-methylsulfanylpropan-2-yl)acetamide
CID 115636054
2-(2-cyanophenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 2706739
2-(2-cyanophenoxy)-N-(1-ethoxypropan-2-yl)acetamide
CID 47903365
(2S,3R)-2-[[2-(2-cyanophenoxy)acetyl]amino]-3-hydroxybutanoic acid
CID 104965105
2-(2-cyanophenoxy)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
CID 2562613
2-(2-cyanophenoxy)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 7742348
N-tert-butyl-2-(2-cyanophenoxy)acetamide
CID 2565352
2-(2-cyanophenoxy)-N-hydroxy-N-methylacetamide
CID 20669597
N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-(2-cyanophenoxy)acetamide
CID 2651244
2-(2-cyanophenoxy)-N-(3-methoxy-2-methylpropyl)acetamide
CID 48685478
2-(2-cyanophenoxy)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]acetamide
CID 8500487

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide (CID 82937600) is 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide is CC(CN(C)C)NC(=O)COc1ccccc1C#N.
What is the InChIKey of 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide?
The InChIKey is YGMYJKIMTKZVHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-11(9-17(2)3)16-14(18)10-19-13-7-5-4-6-12(13)8-15/h4-7,11H,9-10H2,1-3H3,(H,16,18).
What are the key properties of 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide?
2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide has a molecular weight of 261.32 g/mol, XLogP of 1.00, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-[1-(dimethylamino)propan-2-yl]acetamide is sourced from PubChem (CID 82937600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).