4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine

C14H19N3O3 — CID 141223029

IUPAC4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine
SMILESCOc1ccc2c(n1)N(C1COC(C)(C)OC1)C=CN2
InChIInChI=1S/C14H19N3O3/c1-14(2)19-8-10(9-20-14)17-7-6-15-11-4-5-12(18-3)16-13(11)17/h4-7,10,15H,8-9H2,1-3H3
InChIKeyPKDGTCGURGQHIC-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.94
Rot. Bonds2

About 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine

4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine (PubChem CID 141223029) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine
PubChem CID141223029
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine
SMILESCOc1ccc2c(n1)N(C1COC(C)(C)OC1)C=CN2
InChIInChI=1S/C14H19N3O3/c1-14(2)19-8-10(9-20-14)17-7-6-15-11-4-5-12(18-3)16-13(11)17/h4-7,10,15H,8-9H2,1-3H3
InChIKeyPKDGTCGURGQHIC-UHFFFAOYSA-N
XLogP1.94
TPSA55.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine with MolForge

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Related Compounds

4-ethyl-6-methoxy-2,3-dihydro-1H-pyrido[2,3-b]pyrazine
CID 115323647
1-(3-amino-6-methoxy-2-pyridinyl)pyrrolidine-3,4-diol
CID 106667349
5-ethyl-7-methoxy-1,2,3,4-tetrahydropyrido[2,3-b][1,4]diazepine
CID 115323659
1-(3-amino-6-methoxy-2-pyridinyl)-4-methylpiperidin-4-ol
CID 115320981
4,12-dimethoxy-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),10,12-trien-7-one
CID 115323552
3-hydroxy-6-methoxy-3,4-dihydro-1H-1,5-naphthyridin-2-one
CID 53414723
7-methoxy-5-propan-2-yl-3,4-dihydro-1H-pyrido[2,3-b][1,4]diazepin-2-one
CID 113287004
7-methoxy-5-methylspiro[2,3-dihydro-1H-pyrido[2,3-b][1,4]diazepine-4,1'-cyclohexane]
CID 115323681
2-(2,5-dimethylpyrrolidin-1-yl)-6-methoxy-3-methylpyridine
CID 20810705
2-(3-azabicyclo[3.3.1]nonan-3-yl)-6-methoxypyridin-3-amine
CID 114196245
13-methoxy-7-methyl-2,9,14-triazatricyclo[8.4.0.03,7]tetradeca-1(10),11,13-trien-8-one
CID 82763731
6-methoxy-2,4-dihydro-1H-1,5-naphthyridin-3-one
CID 58200875

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine?
The IUPAC name of 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine (CID 141223029) is 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine.
What is the SMILES notation for 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine?
The canonical SMILES for 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine is COc1ccc2c(n1)N(C1COC(C)(C)OC1)C=CN2.
What is the InChIKey of 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine?
The InChIKey is PKDGTCGURGQHIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-14(2)19-8-10(9-20-14)17-7-6-15-11-4-5-12(18-3)16-13(11)17/h4-7,10,15H,8-9H2,1-3H3.
What are the key properties of 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine?
4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine has a molecular weight of 277.32 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethyl-1,3-dioxan-5-yl)-6-methoxy-1H-pyrido[2,3-b]pyrazine is sourced from PubChem (CID 141223029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).