Basic information
- CAS
162272-61-9- Standard SMILES
Cc1nc(N)nc(Cl)c1Cc1ccccc1- InChIKey
NUGQOZJAWOOGSB-UHFFFAOYSA-N- Molecular formula
- C12H12ClN3
- Average molar mass
- 233.69 g/mol
- Monoisotopic mass
- 233.07197506
Names & identifiers
- Preferred name
- 5-Benzyl-4-chloro-6-methylpyrimidin-2-amine
- IUPAC
- 5-benzyl-4-chloro-6-methylpyrimidin-2-amine
- English name
- 2-Pyrimidinamine, 4-chloro-6-methyl-5-(phenylmethyl)-
- Molecular formula
- C12H12ClN3
- Molecular weight
- 233.7
Names & synonyms
5-benzyl-4-chloro-6-methylpyrimidin-2-amine162272-61-94-Chloro-6-methyl-5-(phenylmethyl)-2-pyrimidinamine2-Pyrimidinamine, 4-chloro-6-methyl-5-(phenylmethyl)-SCHEMBL6415745NUGQOZJAWOOGSB-UHFFFAOYSA-NDTXSID301221880AKOS004901055DB-3682555-benzyl-4-chloro-6-methylpyrimidin-2-ylamine5-benzyl-4-chloro-6-methylpyrimidine-2-ylamineAO-262/25094007
Show more names
5-Benzyl-4-chloro-6-methyl-2-pyrimidinamine
F2158-2314
Database identifiers
- CAS
162272-61-9- PubChem CID
- 820238
- DTXSID
DTXSID301221880
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 218
Related reactions
6 records
Compound notes
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