(2-Methylpropyl)[2-(pyridin-2-YL)ethyl]amine
Basic information
- CAS
6311-96-2- Standard SMILES
CC(C)CNCCc1ccccn1- InChIKey
LIYDXVXRMIKYIU-UHFFFAOYSA-N- Molecular formula
- C11H18N2
- Average molar mass
- 178.27 g/mol
- Monoisotopic mass
- 178.14699858
Names & identifiers
- Preferred name
- (2-Methylpropyl)[2-(pyridin-2-YL)ethyl]amine
- IUPAC
- 2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
- English name
- 2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
- Molecular formula
- C11H18N2
- Molecular weight
- 178.27
Names & synonyms
6311-96-2(2-METHYLPROPYL)[2-(PYRIDIN-2-YL)ETHYL]AMINENSC42651NSC-426512-METHYL-N-(2-(PYRIDIN-2-YL)ETHYL)PROPAN-1-AMINE2-Methyl-N-[2-(pyridin-2-yl)ethyl]propan-1-amine2-methyl-N-(2-(2-pyridinyl)ethyl)-1-propanamineNCIStruc1_000131NCIStruc2_000121SCHEMBL3422911CHEMBL1358341DTXSID00285698
Show more names
2-Pyridineethanamine, N-(2-methylpropyl)-2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
NCI42651CCG-36570NCGC00013505AKOS000236113NCGC00013505-02NCGC00096619-012-Pyridineethanamine,n-(2-methylpropyl)-NCI60_003977
Database identifiers
- CAS
6311-96-2- PubChem CID
- 238322
- DTXSID
DTXSID00285698- ChEMBL
CHEMBL1358341
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 123
Physicochemical properties
- Comptox DTXSID
- 285698 · DTXSID00285698
- HS Code
- 2933399090 · 2933399090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933399090
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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