N-(2,5-Dimethyl-1H-pyrrol-1-yl)-2-(di-2-propen-1-ylamino)acetamide
Basic information
- CAS
20627-27-4- Standard SMILES
C=CCN(CC=C)CC(=O)Nn1c(C)ccc1C- InChIKey
LJJAJDMZXHQKFD-UHFFFAOYSA-N- Molecular formula
- C14H21N3O
- Average molar mass
- 247.34 g/mol
- Monoisotopic mass
- 247.1684623
Names & identifiers
- Preferred name
- N-(2,5-Dimethyl-1H-pyrrol-1-yl)-2-(di-2-propen-1-ylamino)acetamide
- IUPAC
- 2-[bis(prop-2-enyl)amino]-N-(2,5-dimethylpyrrol-1-yl)acetamide
- English name
- 2-(Diallylamino)-N-(2,5-dimethyl-1H-pyrrol-1-yl)acetamide
- Molecular formula
- C14H21N3O
- Molecular weight
- 247.34
Names & synonyms
20627-27-4Acetamide, 2-(diallylamino)-N-(2,5-dimethylpyrrol-1-yl)-UWE6Q6173HNSC-90865DTXSID40174653N-(2,5-Dimethyl-1H-pyrrol-1-yl)-2-(di-2-propen-1-ylamino)acetamideRefChem:1090874DTXCID20971442-(Diallylamino)-N-(2,5-dimethylpyrrol-1-yl)acetamideMLS002695038NSC908652-(Diallylamino)-N-(2,5-dimethyl-1H-pyrrol-1-yl)acetamide
Show more names
R-460Acetamide, N-(2,5-dimethyl-1H-pyrrol-1-yl)-2-(di-2-propen-1-ylamino)-
R 460NSC 908652-[bis(prop-2-enyl)amino]-N-(2,5-dimethylpyrrol-1-yl)acetamideBRN 16861222-Diallylaminoacetamido-2,5-dimethylpyrroleAcetamide, 2-(diallylamino)-N-(2,5-dimethyl-1-pyrrolyl)-NCIOpen2_006333UNII-UWE6Q6173H
Database identifiers
- CAS
20627-27-4- PubChem CID
- 72768
- DTXSID
DTXSID40174653- ChEMBL
CHEMBL1902609- UNII
- UWE6Q6173H
- Nikkaji
- J54.071D
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 283
Physicochemical properties
- FDA UNII
- 6 Q6173H · UWE6Q6173H
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Compound notes
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