| CAS Number | 1162640-58-5 |
| Catalog Number | AG00HDPN(AGN-PC-0WNMMP) |
| Chemical Name | 2-Amino-N-isopropyl-DL-propanamide |
| IUPAC Name | 2-amino-N-propan-2-ylpropanamide |
| InChI | InChI=1S/C6H14N2O/c1-4(2)8-6(9)5(3)7/h4-5H,7H2,1-3H3,(H,8,9) |
| InChI Key | QIVCLSJTIRCGKW-UHFFFAOYSA-N |
| MDL Number | MFCD09950394 |
| Molecular Formula | C6H14N2O |
| Molecular Weight | 130.1882 |
| SMILES | CC(NC(C(N)C)=O)C |
| Synonyms | 2-Amino-N-isopropyl-DL-propanamide,
2-AMINO-N-(PROPAN-2-YL)PROPANAMIDE,
1162640-58-5,
N~1~-Isopropylalaninamide hydrochloride,
SCHEMBL10829688,
ALBB-022647,
KM3531,
AKOS000196005,
AKOS016344698,
BB 0262415,
propanamide, 2-amino-N-(1-methylethyl)-, hydrochloride,
2-AMINO-N-ISOPROPYLPROPANAMIDE HYDROCHLORIDE,
1236266-73-1,
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| Complexity | 101 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 130.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 130.191g/mol |
| Monoisotopic Mass | 130.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
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Certificate of Analysis
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