6-Amino-4-(1,4-dioxa-8-azaspiro(4.5)decan-8-yl)-2-iminopyrimidin-1(2H)-ol
Basic information
- CAS
83540-25-4- Standard SMILES
N=c1nc(N2CCC3(CC2)OCCO3)cc(N)n1O- InChIKey
NUZFCTZMZUXYDM-UHFFFAOYSA-N- Molecular formula
- C11H17N5O3
- Average molar mass
- 267.28 g/mol
- Monoisotopic mass
- 267.13313942
Names & identifiers
- Preferred name
- 6-Amino-4-(1,4-dioxa-8-azaspiro(4.5)decan-8-yl)-2-iminopyrimidin-1(2H)-ol
- IUPAC
- 6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-hydroxy-2-iminopyrimidin-4-amine
Names & synonyms
DTXSID6010035426-Amino-4-(1,4-dioxa-8-azaspiro(4.5)decan-8-yl)-2-iminopyrimidin-1(2H)-ol6-Amino-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-iminopyrimidin-1(2H)-olRefChem:1073791DTXCID90143045383540-25-48-(2,6-Diamino-4-pyrimidinyl)-1,4-dioxa-8-azaspiro(4.5)decane 1'-oxide1,4-DIOXA-8-AZASPIRO(4.5)DECANE, 8-(2,6-DIAMINO-4-PYRIMIDINYL)-, 1'-OXIDE
Database identifiers
- CAS
83540-25-4- PubChem CID
- 55042
- DTXSID
DTXSID601003542- Nikkaji
- J76.221K
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 445
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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