| CAS Number | 672310-00-8 |
| Catalog Number | AG0063FS(AGN-PC-078MZ2) |
| Chemical Name | (1-Cyclohexyl-2-pyrrolidin-1-yl-ethyl)-methyl-amine |
| IUPAC Name | 1-cyclohexyl-N-methyl-2-pyrrolidin-1-ylethanamine |
| InChI | InChI=1S/C13H26N2/c1-14-13(11-15-9-5-6-10-15)12-7-3-2-4-8-12/h12-14H,2-11H2,1H3 |
| InChI Key | QHVKQGXQHOCVNK-UHFFFAOYSA-N |
| MDL Number | MFCD03426427 |
| Molecular Formula | C13H26N2 |
| Molecular Weight | 210.3589 |
| SMILES | N1(CCCC1)CC(C1CCCCC1)NC |
| Synonyms | (1-Cyclohexyl-2-pyrrolidin-1-yl-ethyl)-methyl-amine,
672310-00-8,
1-CYCLOHEXYL-N-METHYL-2-(PYRROLIDIN-1-YL)ETHANAMINE,
CTK5C5893,
DTXSID00660704,
MFCD03426427,
AKOS022184309,
AB14924,
AS-40824,
DB-016224,
FT-0740031,
A12853,
X-3315,
2-cyclohexyl-3-(pyrrolidin-1-yl)propan-1-amine,
1-cyclohexyl-N-methyl-2-pyrrolidin-1-ylethanamine,
1-Cyclohexyl-N-methyl-2-(pyrrolidin-1-yl)ethan-1-amine,
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| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.21g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.365g/mol |
| Monoisotopic Mass | 210.21g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
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Certificate of Analysis
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