2-Methyl-5,6-dihydro-1H-pyrrolo[2,3-d]pyrimidin-4-amine
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Basic information
- CAS
106727-80-4- Standard SMILES
Cc1nc(N)c2c(n1)NCC2- InChIKey
QBEQMIXROUWIGL-UHFFFAOYSA-N- Molecular formula
- C7H10N4
- Average molar mass
- 150.18 g/mol
Names & identifiers
- Preferred name
- 2-Methyl-5,6-dihydro-1H-pyrrolo[2,3-d]pyrimidin-4-amine
- IUPAC
- 2-methyl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-amine
- English name
- 1H-Pyrrolo[2,3-d]pyrimidin-4-amine, 5,6-dihydro-2-methyl- (9CI)
- Molecular formula
- C7H10N4
- Molecular weight
- 150.18
Names & synonyms
2-Methyl-5,6-dihydro-1H-pyrrolo[2,3-d]pyrimidin-4-amine106727-80-42-methyl-1H,5H,6H-pyrrolo[2,3-d]pyrimidin-4-amine5H-Pyrrolo[2,3-d]pyrimidin-4-amine, 6,7-dihydro-2-methyl-1H-Pyrrolo[2,3-d]pyrimidin-4-amine, 5,6-dihydro-2-methyl- (9CI)
Database identifiers
- CAS
106727-80-4
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Melting point
- 258 °C · 258 °C
- Boiling point
- 280.3 · 280.3±43.0 °C(Predicted)
- Density
- 1.53 · 1.53±0.1 g/cm3(Predicted)
- pka
- 13.69 · 13.69±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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