Basic information
- CAS
625376-09-2- Standard SMILES
N#CC1=C(N)Oc2c(oc(CO)cc2=O)C1c1cccnc1- InChIKey
SDGVJEBYEJGBTE-UHFFFAOYSA-N- Molecular formula
- C15H11N3O4
- Average molar mass
- 297.26 g/mol
- Monoisotopic mass
- 297.07495584
Names & identifiers
- Preferred name
- 2-Amino-6-(hydroxymethyl)-8-oxo-4-(3-pyridinyl)-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
- IUPAC
- 2-amino-6-(hydroxymethyl)-8-oxo-4-pyridin-3-yl-4H-pyrano[3,2-b]pyran-3-carbonitrile
- English name
- 2-amino-6-(hydroxymethyl)-8-oxo-4-(3-pyridinyl)-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
- Molecular formula
- C15H11N3O4
- Molecular weight
- 297.26554
Names & synonyms
625376-09-22-amino-6-(hydroxymethyl)-8-oxo-4-(3-pyridinyl)-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile2-amino-6-(hydroxymethyl)-8-oxo-4-(pyridin-3-yl)-4H,8H-pyrano[3,2-b]pyran-3-carbonitrile2-amino-6-(hydroxymethyl)-8-oxo-4-pyridin-3-yl-4H-pyrano[3,2-b]pyran-3-carbonitrile2-amino-6-(hydroxymethyl)-8-oxo-4-(pyridin-3-yl)-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrileSTK779350AKOS000666164AKOS016340310SS-0452ST039499AM-807/419290642-amino-6-(hydroxymethyl)-8-oxo-4-(3-pyridyl)-4H-pyrano[3,2-b]pyran-3-carbonit rile
Show more names
2-amino-4-(pyridine-3-yl)-4,8-dihydro-6-(hydroxymethyl)-8-oxo-pyrano[3,2-b]pyran-3-carbonitrile
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 653
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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