[3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol

C12H14N4O2 — CID 156687236

IUPAC[3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol
SMILESCOc1cnccc1-c1nc(CO)c(N)nc1C
InChIInChI=1S/C12H14N4O2/c1-7-11(16-9(6-17)12(13)15-7)8-3-4-14-5-10(8)18-2/h3-5,17H,6H2,1-2H3,(H2,13,15)
InChIKeyKFSWCLMYCBMWMU-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.93
Rot. Bonds3

About [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol

[3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol (PubChem CID 156687236) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol.

Molecular Properties

Compound Name[3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol
PubChem CID156687236
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name[3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol
SMILESCOc1cnccc1-c1nc(CO)c(N)nc1C
InChIInChI=1S/C12H14N4O2/c1-7-11(16-9(6-17)12(13)15-7)8-3-4-14-5-10(8)18-2/h3-5,17H,6H2,1-2H3,(H2,13,15)
InChIKeyKFSWCLMYCBMWMU-UHFFFAOYSA-N
XLogP0.93
TPSA94.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-amino-3-(3-methoxy-4-pyridinyl)pyrazol-1-yl]ethanol
CID 105063635
4-(3-methoxy-4-pyridinyl)-1,3-thiazol-2-amine
CID 105064795
5-(3-methoxy-4-pyridinyl)-2-methyl-1,2,4-triazol-3-amine
CID 105063345
[4-(2-amino-5-methoxy-6-methyl-3-pyridinyl)phenyl]methanol
CID 157013064
4-amino-3-(3-methoxy-4-pyridinyl)-1H-1,2,4-triazole-5-thione
CID 105063706
2-methoxy-5-(3-methyl-4-pyridinyl)aniline
CID 66278830
(7-methoxyisoquinolin-8-yl)methanol
CID 82576311
5-(3-methoxy-4-pyridinyl)pyridin-3-ol
CID 163312957
4-methoxypyridin-3-amine;dihydrochloride
CID 163333119
methyl 6-(aminomethyl)-2-chloro-4-(3-methoxy-4-pyridinyl)pyridine-3-carboxylate
CID 171486910
4-(3-methoxy-6-methyl-2-pyridinyl)pyridine-3-carboxylic acid
CID 175489276
2-methoxy-5-(4-methyl-3-pyridinyl)aniline
CID 66272306

Frequently Asked Questions

What is the IUPAC name of [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol?
The IUPAC name of [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol (CID 156687236) is [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol.
What is the SMILES notation for [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol?
The canonical SMILES for [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol is COc1cnccc1-c1nc(CO)c(N)nc1C.
What is the InChIKey of [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol?
The InChIKey is KFSWCLMYCBMWMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-7-11(16-9(6-17)12(13)15-7)8-3-4-14-5-10(8)18-2/h3-5,17H,6H2,1-2H3,(H2,13,15).
What are the key properties of [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol?
[3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol has a molecular weight of 246.27 g/mol, XLogP of 0.93, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-amino-6-(3-methoxy-4-pyridinyl)-5-methylpyrazin-2-yl]methanol is sourced from PubChem (CID 156687236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).