Basic information
- Standard SMILES
CCCCc1ccc(N=C2NCCCN2)cc1- InChIKey
CIYMQQLOODPCEE-UHFFFAOYSA-N- Molecular formula
- C14H21N3
- Average molar mass
- 231.34 g/mol
- Monoisotopic mass
- 231.17354768
Names & identifiers
- Preferred name
- 2-(4-n-Butylphenyl)imino-hexahydropyrimidine
- IUPAC
- N-(4-butylphenyl)-1,4,5,6-tetrahydropyrimidin-2-amine
Names & synonyms
SCHEMBL11183418CIYMQQLOODPCEE-UHFFFAOYSA-N2-(4-n-butylphenyl)imino-hexahydropyrimidine
Database identifiers
- PubChem CID
- 20493341
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 242
Related reactions
3 records
Compound notes
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