Cas no 61275-31-8 (D-Alaninamide, D-alanyl-N-methyl-)
61275-31-8 structure
Product Name:D-Alaninamide, D-alanyl-N-methyl-
CAS No:61275-31-8
MF:C7H15N3O2
MW:173.212901353836
CID:486168
PubChem ID:71397521
Update Time:2025-04-19
D-Alaninamide, D-alanyl-N-methyl- Chemical and Physical Properties
Names and Identifiers
-
- D-Alaninamide, D-alanyl-N-methyl-
- (2R)-2-amino-N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]propanamide
- DTXSID20819015
- 61275-31-8
- D-Alanyl-N-methyl-D-alaninamide
- SCHEMBL17506496
-
- Inchi： 1S/C7H15N3O2/c1-4(8)6(11)10-5(2)7(12)9-3/h4-5H,8H2,1-3H3,(H,9,12)(H,10,11)/t4-,5-/m1/s1
- InChI Key： YGIVVAKQDXCPKN-RFZPGFLSSA-N
- SMILES： O=C([C@@H](C)N)N[C@@H](C(NC)=O)C
Computed Properties
- Exact Mass: 173.11655
- Monoisotopic Mass: 173.116426730g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 182
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.7
- Topological Polar Surface Area: 84.2?2
Experimental Properties
- PSA: 84.22
D-Alaninamide, D-alanyl-N-methyl- Related Literature
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
-
Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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