Basic information
- CAS
69061-85-4- Standard SMILES
NCn1cnc2ccccc2c1=O- InChIKey
TUYJMWQCRJULQY-UHFFFAOYSA-N- Molecular formula
- C9H9N3O
- Average molar mass
- 175.19 g/mol
- Monoisotopic mass
- 175.07456192
Names & identifiers
- Preferred name
- 3-(Aminomethyl)quinazolin-4(3h)-one
- IUPAC
- 3-(aminomethyl)quinazolin-4-one
Names & synonyms
3-(aminomethyl)quinazolin-4(3h)-one69061-85-43-(aminomethyl)-3,4-dihydroquinazolin-4-oneDTXSID10275681
Database identifiers
- CAS
69061-85-4- PubChem CID
- 63164
- DTXSID
DTXSID10275681
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 239
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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