Basic information
- CAS
31562-54-6- Standard SMILES
Cc1[nH]c(=O)[nH]c(=O)c1NCCO- InChIKey
JJYCGTAEWKCZIP-UHFFFAOYSA-N- Molecular formula
- C7H11N3O3
- Average molar mass
- 185.18 g/mol
- Monoisotopic mass
- 185.08004122
Names & identifiers
- Preferred name
- 5-[(2-hydroxyethyl)amino]-6-methylpyrimidine-2,4(1H,3H)-dione
- IUPAC
- 5-(2-hydroxyethylamino)-6-methyl-1H-pyrimidine-2,4-dione
Names & synonyms
31562-54-6HMS1608M20NSC172602DTXSID103059125-[(2-hydroxyethyl)amino]-6-methylpyrimidine-2,4(1H,3H)-dioneAKOS001605111CCG-104104NSC-172602EU-00016975-[(2-hydroxyethyl)amino]-6-methyl-2,4(1H,3H)-pyrimidinedione
Database identifiers
- CAS
31562-54-6- PubChem CID
- 299518
- DTXSID
DTXSID10305912
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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