5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine

C15H21FN4O — CID 138508236

About 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine

5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine (PubChem CID 138508236) has the molecular formula C15H21FN4O and a molecular weight of 292.36 g/mol. Its IUPAC name is 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine.

Molecular Properties

• Compound Name: 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine
• PubChem CID: 138508236
• Molecular Formula: C15H21FN4O
• Molecular Weight: 292.36 g/mol
• Exact Mass: 292.17
• IUPAC Name: 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine
• SMILES: COc1ccc(F)cc1CN1CCNC(N)=C1/C=C(/C)N
• InChI: InChI=1S/C15H21FN4O/c1-10(17)7-13-15(18)19-5-6-20(13)9-11-8-12(16)3-4-14(11)21-2/h3-4,7-8,19H,5-6,9,17-18H2,1-2H3/b10-7-
• InChIKey: BGDYRUSYIXZZLI-YFHOEESVSA-N
• XLogP: 1.23
• TPSA: 76.54 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	292.36
LogP ≤ 5	1.23
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine?

The IUPAC name of 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine (CID 138508236) is 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine.

What is the SMILES notation for 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine?

The canonical SMILES for 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine is COc1ccc(F)cc1CN1CCNC(N)=C1/C=C(/C)N.

What is the InChIKey of 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine?

The InChIKey is BGDYRUSYIXZZLI-YFHOEESVSA-N. The full InChI is InChI=1S/C15H21FN4O/c1-10(17)7-13-15(18)19-5-6-20(13)9-11-8-12(16)3-4-14(11)21-2/h3-4,7-8,19H,5-6,9,17-18H2,1-2H3/b10-7-.

What are the key properties of 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine?

5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine has a molecular weight of 292.36 g/mol, XLogP of 1.23, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine is sourced from PubChem (CID 138508236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).