5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine

C19H19N5 — CID 135152842

IUPAC5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine
SMILESCC1(C)N=C(c2cnc3ccccc3n2)c2ncncc2C1(C)C
InChIInChI=1S/C19H19N5/c1-18(2)12-9-20-11-22-16(12)17(24-19(18,3)4)15-10-21-13-7-5-6-8-14(13)23-15/h5-11H,1-4H3
InChIKeyXRBMZLSVJGMBDN-UHFFFAOYSA-N
MW317.40 g/mol
LogP3.33
Rot. Bonds1

About 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine

5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine (PubChem CID 135152842) has the molecular formula C19H19N5 and a molecular weight of 317.40 g/mol. Its IUPAC name is 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine.

Molecular Properties

Compound Name5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine
PubChem CID135152842
Molecular FormulaC19H19N5
Molecular Weight317.40 g/mol
Exact Mass317.16
IUPAC Name5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine
SMILESCC1(C)N=C(c2cnc3ccccc3n2)c2ncncc2C1(C)C
InChIInChI=1S/C19H19N5/c1-18(2)12-9-20-11-22-16(12)17(24-19(18,3)4)15-10-21-13-7-5-6-8-14(13)23-15/h5-11H,1-4H3
InChIKeyXRBMZLSVJGMBDN-UHFFFAOYSA-N
XLogP3.33
TPSA63.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.40
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4,4-difluoro-2,5,5-trimethylpyrazolo[3,4-c]pyridin-7-yl)quinoxaline
CID 142383413
2-(3,3,4,4-tetramethylisoquinolin-1-yl)thieno[2,3-b]pyrazine
CID 135152778
2-(7,7-difluoro-1,6,6-trimethylpyrrolo[3,2-c]pyridin-4-yl)quinoxaline
CID 142383447
2-(3,3,4,4-tetramethylisoquinolin-1-yl)-5,6,7,8-tetrahydroquinoxaline
CID 135152929
2-methyl-3-quinoxalin-2-ylquinoxaline
CID 171905215
2-quinazolin-6-ylquinoxaline
CID 135299830
2-(3,5-dimethoxyphenyl)quinoxaline
CID 102112241
2-(5-methylthiophen-2-yl)quinoxaline
CID 10680762
hydron;phenazine
CID 175446889
1-(4-methoxyquinolin-2-yl)-3,3,4,4-tetramethylisoquinoline
CID 135152438
2-(5-chloropyrimidin-4-yl)quinoline
CID 105371578
2-(2,4,6-trimethylphenyl)quinoxaline
CID 39830827

Frequently Asked Questions

What is the IUPAC name of 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine?
The IUPAC name of 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine (CID 135152842) is 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine.
What is the SMILES notation for 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine?
The canonical SMILES for 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine is CC1(C)N=C(c2cnc3ccccc3n2)c2ncncc2C1(C)C.
What is the InChIKey of 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine?
The InChIKey is XRBMZLSVJGMBDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5/c1-18(2)12-9-20-11-22-16(12)17(24-19(18,3)4)15-10-21-13-7-5-6-8-14(13)23-15/h5-11H,1-4H3.
What are the key properties of 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine?
5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine has a molecular weight of 317.40 g/mol, XLogP of 3.33, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,6,6-tetramethyl-8-quinoxalin-2-ylpyrido[3,4-d]pyrimidine is sourced from PubChem (CID 135152842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).