(2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine

C12H12FN3O — CID 104515551

IUPAC(2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine
SMILESCOc1nccnc1C(N)c1ccccc1F
InChIInChI=1S/C12H12FN3O/c1-17-12-11(15-6-7-16-12)10(14)8-4-2-3-5-9(8)13/h2-7,10H,14H2,1H3
InChIKeyRMGPXVUCKCFLRZ-UHFFFAOYSA-N
MW233.25 g/mol
LogP1.67
Rot. Bonds3

About (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine

(2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine (PubChem CID 104515551) has the molecular formula C12H12FN3O and a molecular weight of 233.25 g/mol. Its IUPAC name is (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine.

Molecular Properties

Compound Name(2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine
PubChem CID104515551
Molecular FormulaC12H12FN3O
Molecular Weight233.25 g/mol
Exact Mass233.10
IUPAC Name(2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine
SMILESCOc1nccnc1C(N)c1ccccc1F
InChIInChI=1S/C12H12FN3O/c1-17-12-11(15-6-7-16-12)10(14)8-4-2-3-5-9(8)13/h2-7,10H,14H2,1H3
InChIKeyRMGPXVUCKCFLRZ-UHFFFAOYSA-N
XLogP1.67
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 ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2-fluorophenyl)-(3-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

(2,3-difluorophenyl)-(3-methoxypyrazin-2-yl)methanamine
CID 105032053
(2-bromo-3,4-difluorophenyl)-(3-methoxypyrazin-2-yl)methanamine
CID 107538859
(2,6-dimethyl-3-pyridinyl)-(3-methoxypyrazin-2-yl)methanamine
CID 105178660
(3-chloro-4-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine
CID 104515565
(3-methoxypyrazin-2-yl)-(4-methylthiophen-3-yl)methanamine
CID 104515940
[(3-methoxypyrazin-2-yl)-(2-methylsulfanylphenyl)methyl]hydrazine
CID 105332642
2-(2-fluorophenyl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105090092
(2-fluoro-5-methylphenyl)-(2-methoxy-3-pyridinyl)methanamine
CID 105143130
(3-methoxypyrazin-2-yl)-pyrimidin-4-ylmethanamine
CID 104515599
(2-fluorophenyl)-(6-methoxypyridazin-3-yl)methanamine
CID 103374032
N-[1-(2-fluorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721902
N-[(2,6-difluorophenyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 104515889

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine?
The IUPAC name of (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine (CID 104515551) is (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine.
What is the SMILES notation for (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine?
The canonical SMILES for (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine is COc1nccnc1C(N)c1ccccc1F.
What is the InChIKey of (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine?
The InChIKey is RMGPXVUCKCFLRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FN3O/c1-17-12-11(15-6-7-16-12)10(14)8-4-2-3-5-9(8)13/h2-7,10H,14H2,1H3.
What are the key properties of (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine?
(2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine has a molecular weight of 233.25 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanamine is sourced from PubChem (CID 104515551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).