Basic information
- CAS
156309-07-8- Standard SMILES
O=C(Nc1ccccc1)C1=NCCCN1- InChIKey
CKLGZFAZRZPYOR-UHFFFAOYSA-N- Molecular formula
- C11H13N3O
- Average molar mass
- 203.24 g/mol
- Monoisotopic mass
- 203.10586205
Names & identifiers
- Preferred name
- N-Phenyl-1,4,5,6-tetrahydro-2-pyrimidinecarboxamide
- IUPAC
- N-phenyl-1,4,5,6-tetrahydropyrimidine-2-carboxamide
- English name
- N-Phenyl-1,4,5,6-tetrahydro-2-pyrimidinecarboxamide
- Molecular formula
- C11H13N3O
- Molecular weight
- 203.24
Names & synonyms
N-Phenyl-1,4,5,6-tetrahydro-2-pyrimidinecarboxamide156309-07-8DTXSID10336847RefChem:364751DTXCID00287935N-phenyl-1,4,5,6-tetrahydropyrimidine-2-carboxamideCKLGZFAZRZPYOR-UHFFFAOYSA-NAKOS025142266N-Phenyl-1,4,5,6-tetrahydro-2-pyrimidinecarboxamide #Pyrimidine-2-carboxamide, 3,4,5,6-tetrahydro-N-phenyl-2-Pyrimidinecarboxamide, 1,4,5,6-tetrahydro-N-phenyl-
Database identifiers
- CAS
156309-07-8- PubChem CID
- 536747
- DTXSID
DTXSID10336847
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 53.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 257
Physicochemical properties
- Density
- 1.23 · 1.23±0.1 g/cm3(Predicted)
- pka
- 12.85 · 12.85±0.70(Predicted)
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
OTAVA-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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