3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine

C14H10N6O — CID 71295237

IUPAC3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine
SMILESCc1nc2ccncc2nc1On1nnc2ccccc21
InChIInChI=1S/C14H10N6O/c1-9-14(17-12-8-15-7-6-10(12)16-9)21-20-13-5-3-2-4-11(13)18-19-20/h2-8H,1H3
InChIKeyFLYVGUZNMSEDBL-UHFFFAOYSA-N
MW278.28 g/mol
LogP1.92
Rot. Bonds2

About 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine

3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine (PubChem CID 71295237) has the molecular formula C14H10N6O and a molecular weight of 278.28 g/mol. Its IUPAC name is 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine.

Molecular Properties

Compound Name3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine
PubChem CID71295237
Molecular FormulaC14H10N6O
Molecular Weight278.28 g/mol
Exact Mass278.09
IUPAC Name3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine
SMILESCc1nc2ccncc2nc1On1nnc2ccccc21
InChIInChI=1S/C14H10N6O/c1-9-14(17-12-8-15-7-6-10(12)16-9)21-20-13-5-3-2-4-11(13)18-19-20/h2-8H,1H3
InChIKeyFLYVGUZNMSEDBL-UHFFFAOYSA-N
XLogP1.92
TPSA78.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1-(benzotriazol-1-yloxy)-7-chloro-2,6-naphthyridine
CID 172600748
methane;1-methoxybenzotriazole
CID 161160564
1-[2-(benzotriazol-1-yloxy)pyrimidin-5-yl]oxybenzotriazole
CID 59246660
1-(4-methoxypyrimidin-2-yl)oxybenzotriazole
CID 67560438
1-(7-bromo-6-methyl-8-pyrimidin-2-ylpyrrolo[1,2-a]pyrazin-1-yl)oxybenzotriazole
CID 171535724
azanium 1-oxidobenzotriazole
CID 23118068
2-(benzotriazol-1-yloxy)-5-bromopyrimidin-4-amine
CID 24750821
2-methyl-3-propan-2-yloxyquinoxaline
CID 1365294
1-(propan-2-yloxymethoxy)benzotriazole
CID 121265115
benzotriazol-1-yloxy-bis(dimethylamino)phosphanium
CID 19790982
1-(benzotriazol-1-yloxy)-1-fluoro-N,N,N',N'-tetramethylmethanediamine
CID 141407796
N-[benzotriazol-1-yloxy(fluoro)phosphanyl]-N-methylmethanamine
CID 159393127

Frequently Asked Questions

What is the IUPAC name of 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine?
The IUPAC name of 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine (CID 71295237) is 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine.
What is the SMILES notation for 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine?
The canonical SMILES for 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine is Cc1nc2ccncc2nc1On1nnc2ccccc21.
What is the InChIKey of 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine?
The InChIKey is FLYVGUZNMSEDBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N6O/c1-9-14(17-12-8-15-7-6-10(12)16-9)21-20-13-5-3-2-4-11(13)18-19-20/h2-8H,1H3.
What are the key properties of 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine?
3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine has a molecular weight of 278.28 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzotriazol-1-yloxy)-2-methylpyrido[3,4-b]pyrazine is sourced from PubChem (CID 71295237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).