| CAS Number | 953907-35-2 |
| Catalog Number | AG01A7KI |
| Chemical Name | [2-(4-ethylpiperazin-1-yl)pyridin-4-yl]methanamine |
| IUPAC Name | [2-(4-ethylpiperazin-1-yl)pyridin-4-yl]methanamine |
| InChI | InChI=1S/C12H20N4/c1-2-15-5-7-16(8-6-15)12-9-11(10-13)3-4-14-12/h3-4,9H,2,5-8,10,13H2,1H3 |
| InChI Key | RVIFLPFRMQLWBE-UHFFFAOYSA-N |
| MDL Number | MFCD09731485 |
| Molecular Formula | C12H20N4 |
| Molecular Weight | 220.3140 |
| SMILES | CCN1CCN(C2=NC=CC(CN)=C2)CC1 |
| Synonyms | [2-(4-ethylpiperazin-1-yl)pyridin-4-yl]methanamine,
953907-35-2,
AC1Q316P,
SCHEMBL18049108,
ZINC22172573,
AKOS000140153,
MCULE-2961748141,
NE50975,
EN300-59010,
Z1222278740,
|
| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.169g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.32g/mol |
| Monoisotopic Mass | 220.169g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 45.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number