9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol

C15H19N3O2 — CID 143110056

IUPAC9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol
SMILESCc1nc2cc3c(cc2nc1C)C(N)C(O)C(C)(C)O3
InChIInChI=1S/C15H19N3O2/c1-7-8(2)18-11-6-12-9(5-10(11)17-7)13(16)14(19)15(3,4)20-12/h5-6,13-14,19H,16H2,1-4H3
InChIKeyHRZXOTZOSHVFST-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.78
Rot. Bonds

About 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol

9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol (PubChem CID 143110056) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol.

Molecular Properties

Compound Name9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol
PubChem CID143110056
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol
SMILESCc1nc2cc3c(cc2nc1C)C(N)C(O)C(C)(C)O3
InChIInChI=1S/C15H19N3O2/c1-7-8(2)18-11-6-12-9(5-10(11)17-7)13(16)14(19)15(3,4)20-12/h5-6,13-14,19H,16H2,1-4H3
InChIKeyHRZXOTZOSHVFST-UHFFFAOYSA-N
XLogP1.78
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol?
The IUPAC name of 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol (CID 143110056) is 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol.
What is the SMILES notation for 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol?
The canonical SMILES for 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol is Cc1nc2cc3c(cc2nc1C)C(N)C(O)C(C)(C)O3.
What is the InChIKey of 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol?
The InChIKey is HRZXOTZOSHVFST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-7-8(2)18-11-6-12-9(5-10(11)17-7)13(16)14(19)15(3,4)20-12/h5-6,13-14,19H,16H2,1-4H3.
What are the key properties of 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol?
9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol has a molecular weight of 273.34 g/mol, XLogP of 1.78, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-2,3,7,7-tetramethyl-8,9-dihydropyrano[2,3-g]quinoxalin-8-ol is sourced from PubChem (CID 143110056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).