3-((7-Methyl-Benzoxazol-2-ylmethyl)amino)-5-ethyl-6-methlpyridin-2(1H)-one
Basic information
- CAS
135525-76-7- Standard SMILES
CCc1cc(NCc2nc3cccc(C)c3o2)c(=O)[nH]c1C- InChIKey
HASDKQMKEXOVJW-UHFFFAOYSA-N- Molecular formula
- C17H19N3O2
- Average molar mass
- 297.35 g/mol
- Monoisotopic mass
- 297.14772686
Names & identifiers
- Preferred name
- 3-((7-Methyl-Benzoxazol-2-ylmethyl)amino)-5-ethyl-6-methlpyridin-2(1H)-one
- IUPAC
- 5-ethyl-6-methyl-3-[(7-methyl-1,3-benzoxazol-2-yl)methylamino]-1H-pyridin-2-one
Names & synonyms
135525-76-73-((7-Methyl-Benzoxazol-2-ylmethyl)amino)-5-ethyl-6-methlpyridin-2(1H)-oneDTXSID901594553-[(7-Methyl-Benzoxazol-2-ylmethyl)amino]-5-ethyl-6-methlpyridin-2(1H)-oneRefChem:273011DTXCID3081946Pyridinone deriv. 12CHEMBL99992BDBM1312SCHEMBL91707265-ethyl-6-methyl-3-[(7-methyl-1,3-benzoxazol-2-yl)methylamino]-1H-pyridin-2-one5-ethyl-6-methyl-3-{[(7-methyl-1,3-benzoxazol-2-yl)methyl]amino}-1,2-dihydropyridin-2-one
Show more names
DB-3825895-Ethyl-6-methyl-3-[[(7-methyl-2-benzoxazolyl)methyl]amino]-2(1H)-pyridinone5-Ethyl-6-methyl-3-{[(7-methyl-1,3-benzoxazol-2-yl)methyl]amino}pyridin-2(1H)-one
Database identifiers
- CAS
135525-76-7- PubChem CID
- 453443
- DTXSID
DTXSID90159455- ChEMBL
CHEMBL99992- Nikkaji
- J425.116D
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 512
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Compound notes
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