((2-[(Aminoacetyl)amino]-4-methylpentanoyl)amino)acetic acid
Basic information
- CAS
2576-67-2- Standard SMILES
CC(C)CC(NC(=O)CN)C(=O)NCC(=O)O- InChIKey
FYTUIWKTAMMURK-UHFFFAOYSA-N- Molecular formula
- C10H19N3O4
- Average molar mass
- 245.28 g/mol
- Monoisotopic mass
- 245.1375561
Names & identifiers
- Preferred name
- ((2-[(Aminoacetyl)amino]-4-methylpentanoyl)amino)acetic acid
- IUPAC
- 2-[[2-[(2-aminoacetyl)amino]-4-methylpentanoyl]amino]acetic acid
- English name
- N-(1-Methylpropyl)-4-pyridinecarboxamide
- Molecular formula
- C10H14N2O
- Molecular weight
- 178.23
Names & synonyms
Glycine, N-(N-glycyl-L-leucyl)-NSC-89616NSC89616Gly-DL-Leu-GlyGlycyl-DL-leucylglycineGlycyl-D,L-leucylglycinF93TYS5W5GNCIOpen2_006162CHEMBL300799Glycine, N-(N-glycylleucyl)-SCHEMBL13401853DTXSID50953259
Show more names
N-sec-Butyl-isonicotinamide4-Pyridinecarboxamide, N-(1-methylpropyl)-
Glycine, N-(N-glycyl-DL-leucyl)-59685-29-92-[2-(2-Aminoacetamido)-4-methylpentanamido]acetic acid((2-[(Aminoacetyl)amino]-4-methylpentanoyl)amino)acetic acidN-{2-[(2-Amino-1-hydroxyethylidene)amino]-1-hydroxy-4-methylpentylidene}glycine
Database identifiers
- CAS
2576-67-2、311793-05-2、59685-29-9- PubChem CID
- 259586
- DTXSID
DTXSID50953259- ChEMBL
CHEMBL300799- UNII
- F93TYS5W5G
Properties
Computed structural properties
- XLogP
- -3.1
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 291
Physicochemical properties
- Boiling point
- 359.6 · 359.6±15.0 °C(Predicted)
- Density
- 1.03 · 1.030±0.06 g/cm3(Predicted)
- pka
- 13.68 · 13.68±0.46(Predicted)
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Compound notes
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