[(2-Bromo-pyridin-4-ylmethyl)-isopropyl-amino]-acetic acid
Basic information
- CAS
1353962-22-7- Standard SMILES
CC(C)N(CC(=O)O)Cc1ccnc(Br)c1- InChIKey
YYQLHPPFYDYWDG-UHFFFAOYSA-N- Molecular formula
- C11H15BrN2O2
- Average molar mass
- 287.15 g/mol
- Monoisotopic mass
- 286.03169
Names & identifiers
- Preferred name
- [(2-Bromo-pyridin-4-ylmethyl)-isopropyl-amino]-acetic acid
- IUPAC
- 2-[(2-bromo-4-pyridinyl)methyl-propan-2-ylamino]acetic acid
- English name
- [(2-BroMo-pyridin-4-ylMethyl)-isopropyl-aMino]-acetic acid
- Molecular formula
- C11H15BrN2O2
- Molecular weight
- 287.153
Names & synonyms
1353962-22-7[(2-Bromo-pyridin-4-ylmethyl)-isopropyl-amino]-acetic acid2-(((2-Bromopyridin-4-yl)methyl)(isopropyl)amino)acetic acid2-[(2-bromopyridin-4-yl)methyl-propan-2-ylamino]acetic acidDTXSID601190608DB-248364N-[(2-Bromopyridin-4-yl)methyl]-N-propan-2-ylglycine2-[(2-bromo-4-pyridyl)methyl-isopropyl-amino]acetic acid2-(((2-Bromopyridin-4-yl)methyl)(isopropyl)amino)aceticacidGlycine, N-[(2-bromo-4-pyridinyl)methyl]-N-(1-methylethyl)-
Database identifiers
- CAS
1353962-22-7- PubChem CID
- 66568629
- DTXSID
DTXSID601190608
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 53.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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