Basic information
- CAS
2827-43-2- Standard SMILES
Nc1nc(N)nc(N2CCCC2)n1- InChIKey
ILSOYWQFPDVKPE-UHFFFAOYSA-N- Molecular formula
- C7H12N6
- Average molar mass
- 180.21 g/mol
- Monoisotopic mass
- 180.11234441
Names & identifiers
- Preferred name
- s-Triazine, 2,4-diamino-6-(1-pyrrolidinyl)-
- IUPAC
- 6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
Names & synonyms
s-Triazine, 2,4-diamino-6-(1-pyrrolidinyl)-ENT 51112BRN 01880142827-43-2AI3-511122,4-Diamino-6-(1-pyrrolidinyl)-s-triazine6-(1-Pyrrolidinyl)-1,3,5-triazine-2,4-diamine1,3,5-Triazine-2,4-diamine, 6-(1-pyrrolidinyl)-DTXSID501825224-26-00-01270 (Beilstein Handbook Reference)RefChem:379654DTXCID90105013
Show more names
1,3,5-Triazine-2,4-diamine, 6-(1-pyrrolidinyl)-(9CI)SCHEMBL21325614AKOS0062751156-(pyrrolidin-1-yl)-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
2827-43-2- PubChem CID
- 200843
- DTXSID
DTXSID50182522
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 94 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 158
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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