| CAS Number | 1092294-32-0 |
| Catalog Number | AG009KNL |
| Chemical Name | 1-Benzyl-N-isopropylpyrrolidin-3-amine |
| IUPAC Name | 1-benzyl-N-propan-2-ylpyrrolidin-3-amine |
| InChI | InChI=1S/C14H22N2/c1-12(2)15-14-8-9-16(11-14)10-13-6-4-3-5-7-13/h3-7,12,14-15H,8-11H2,1-2H3 |
| InChI Key | ZELZJSMTYJIMIM-UHFFFAOYSA-N |
| MDL Number | MFCD10692135 |
| Molecular Formula | C14H22N2 |
| Molecular Weight | 218.3379 |
| SMILES | CC(C)NC1CCN(CC2=CC=CC=C2)C1 |
| Synonyms | (1-Benzyl-pyrrolidin-3-yl)-isopropyl-amine,
1092294-32-0,
1-Benzyl-N-isopropylpyrrolidin-3-amine,
(R)-1-Benzyl-N-isopropylpyrrolidin-3-amine,
(S)-1-Benzyl-N-isopropylpyrrolidin-3-amine,
SCHEMBL278467,
AKOS009079481,
AM90599,
(1-benzylpyrrolidin-3-yl)isopropylamine,
1354009-82-7,
1354019-30-9,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.344g/mol |
| Monoisotopic Mass | 218.178g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number