Basic information
- CAS
16699-13-1- Standard SMILES
CCC(=O)Nc1ncccn1- InChIKey
DWTFNIVLILBVAQ-UHFFFAOYSA-N- Molecular formula
- C7H9N3O
- Average molar mass
- 151.17 g/mol
- Monoisotopic mass
- 151.07456192
Names & identifiers
- Preferred name
- N-2-Pyrimidinylpropanamide
- IUPAC
- N-pyrimidin-2-ylpropanamide
- English name
- N-pyrimidin-2-yl-propionamide
- Molecular formula
- C7H9N3O
- Molecular weight
- 151.17
Names & synonyms
16699-13-1N-2-PyrimidinylpropanamideRefChem:363026N-pyrimidin-2-ylpropanamideN-pyrimidin-2-yl-propionamideN-(PYRIMIDIN-2-YL)PROPANAMIDEpyrimidinyl propionamideSCHEMBL4409751DTXSID401311262AKOS003872934Propanamide, N-2-pyrimidinyl-
Database identifiers
- CAS
16699-13-1- PubChem CID
- 4622992
- DTXSID
DTXSID401311262- Nikkaji
- J3.136.124I
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 54.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 132
Physicochemical properties
- Density
- 1.204 · 1.204±0.06 g/cm3(Predicted)
- pka
- 12.51 · 12.51±0.70(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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