| CAS Number | 883549-96-0 |
| Catalog Number | AG01AHFM(AGN-PC-0WBUFE) |
| Chemical Name | 1-(Piperidin-4-ylmethyl)indoline |
| IUPAC Name | 1-(piperidin-4-ylmethyl)-2,3-dihydroindole |
| InChI | InChI=1S/C14H20N2/c1-2-4-14-13(3-1)7-10-16(14)11-12-5-8-15-9-6-12/h1-4,12,15H,5-11H2 |
| InChI Key | VABLPIUSNHGKPZ-UHFFFAOYSA-N |
| MDL Number | MFCD06801219 |
| Molecular Formula | C14H20N2 |
| Molecular Weight | 216.3220 |
| SMILES | C(N1C2=C(C=CC=C2)CC1)C1CCNCC1 |
| Synonyms | 1-(Piperidin-4-ylmethyl)indoline,
883549-96-0,
1-(piperidin-4-ylmethyl)-2,3-dihydro-1H-indole,
SCHEMBL15785123,
ZINC11805339,
AKOS000183392,
MCULE-9847034412,
NCGC00330290-01,
AJ-60205,
TR-043293,
1-(piperidin-4-ylmethyl)-2,3-dihydroindole,
BB 0220162,
EN300-74539,
Z-0538,
AB01324957-02,
1-[(piperidin-4-yl)methyl]-2,3-dihydro-1H-indole,
Z1171217422,
|
| Complexity | 223 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.328g/mol |
| Monoisotopic Mass | 216.163g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number