| CAS Number | 3766-03-8 |
| Catalog Number | AG00BYN5(AGN-PC-0REFPV) |
| Chemical Name | 3-(2-Pyrrolidinyl)-1H-Indole |
| IUPAC Name | 3-pyrrolidin-2-yl-1H-indole |
| InChI | InChI=1S/C12H14N2/c1-2-5-11-9(4-1)10(8-14-11)12-6-3-7-13-12/h1-2,4-5,8,12-14H,3,6-7H2 |
| InChI Key | MAVAXPFTVGSHTB-UHFFFAOYSA-N |
| MDL Number | MFCD01718576 |
| Molecular Formula | C12H14N2 |
| Molecular Weight | 186.2530 |
| SMILES | C1CC(C2C3=C(C=CC=C3)NC=2)NC1 |
| Synonyms | 3-(pyrrolidin-2-yl)-1H-indole,
3-(2-Pyrrolidinyl)indole,
3766-03-8,
BRN 0152014,
3-(2-pyrrolidinyl)-1H-indole,
INDOLE, 3-(2-PYRROLIDINYL)-,
1H-Indole, 3-(2-pyrrolidinyl)-,
AC1L2EFD,
3-pyrrolidin-2-yl-1H-indole,
BBL021228,
STK893934,
AKOS005143746,
LS-83396,
3-(2-Pyrrolidinyl)-1H-indole, AldrichCPR,
H9034,
3-piperidin-2-yl-1H-indole,
CID19585,
5-23-07-00373 (Beilstein Handbook Reference),
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| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.258g/mol |
| Monoisotopic Mass | 186.116g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 27.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
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