[6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine

C12H12FN3O — CID 83850538

IUPAC[6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine
SMILESCOc1ncc(CN)nc1-c1cccc(F)c1
InChIInChI=1S/C12H12FN3O/c1-17-12-11(16-10(6-14)7-15-12)8-3-2-4-9(13)5-8/h2-5,7H,6,14H2,1H3
InChIKeyOHVKENHTNFAWIS-UHFFFAOYSA-N
MW233.25 g/mol
LogP1.75
Rot. Bonds3

About [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine

[6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine (PubChem CID 83850538) has the molecular formula C12H12FN3O and a molecular weight of 233.25 g/mol. Its IUPAC name is [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine.

Molecular Properties

Compound Name[6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine
PubChem CID83850538
Molecular FormulaC12H12FN3O
Molecular Weight233.25 g/mol
Exact Mass233.10
IUPAC Name[6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine
SMILESCOc1ncc(CN)nc1-c1cccc(F)c1
InChIInChI=1S/C12H12FN3O/c1-17-12-11(16-10(6-14)7-15-12)8-3-2-4-9(13)5-8/h2-5,7H,6,14H2,1H3
InChIKeyOHVKENHTNFAWIS-UHFFFAOYSA-N
XLogP1.75
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.25
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[6-(4-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine
CID 83850539
[5-(3-fluorophenyl)-6-methoxy-2-pyridinyl]methanol
CID 131870133
5-[[6-[3-(difluoromethoxy)phenyl]-5-methoxypyrazin-2-yl]methyl]pyrimidine-2-carboxamide
CID 90415667
3-(3-fluorophenyl)-2-methoxy-6-methylpyridine
CID 46312939
3-(3-fluorophenyl)-2-methoxy-4,6-dimethylpyridine
CID 141360585
5-(3-fluorophenyl)-2-methoxypyridine-3-carboxylic acid
CID 46314070
2-[2-(3-fluorophenyl)-4-methoxypyrimidin-5-yl]acetic acid
CID 117225482
[4-(5-fluoro-2-methoxy-3-pyridinyl)phenyl]methanamine
CID 67244915
5-(3-fluorophenyl)-2-methoxypyridine
CID 46313001
[5-(3-fluorophenyl)-2-methoxyphenyl]methanamine
CID 54911914
(5,6-dimethoxy-2-pyridinyl)methanamine;N-[(5,6-dimethoxy-2-pyridinyl)methyl]-2-(3-fluorophenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxamide;2-(3-fluorophenyl)-5-(5-methyl-3-pyridinyl)pyridine-3-carboxylic acid;hydrochloride
CID 159505964
3-(3-fluorophenyl)-2-methoxy-5-(1,2,4-triazol-1-ylmethyl)pyridine
CID 86297536

Frequently Asked Questions

What is the IUPAC name of [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine?
The IUPAC name of [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine (CID 83850538) is [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine.
What is the SMILES notation for [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine?
The canonical SMILES for [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine is COc1ncc(CN)nc1-c1cccc(F)c1.
What is the InChIKey of [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine?
The InChIKey is OHVKENHTNFAWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FN3O/c1-17-12-11(16-10(6-14)7-15-12)8-3-2-4-9(13)5-8/h2-5,7H,6,14H2,1H3.
What are the key properties of [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine?
[6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine has a molecular weight of 233.25 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-fluorophenyl)-5-methoxypyrazin-2-yl]methanamine is sourced from PubChem (CID 83850538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).