1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine

C14H17FN4 — CID 63014492

IUPAC1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine
SMILESCC(N)c1ccc(N2CCn3ccnc3C2)c(F)c1
InChIInChI=1S/C14H17FN4/c1-10(16)11-2-3-13(12(15)8-11)19-7-6-18-5-4-17-14(18)9-19/h2-5,8,10H,6-7,9,16H2,1H3
InChIKeyXQUKUGKOBDAYAH-UHFFFAOYSA-N
MW260.32 g/mol
LogP2.06
Rot. Bonds2

About 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine

1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine (PubChem CID 63014492) has the molecular formula C14H17FN4 and a molecular weight of 260.32 g/mol. Its IUPAC name is 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine.

Molecular Properties

Compound Name1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine
PubChem CID63014492
Molecular FormulaC14H17FN4
Molecular Weight260.32 g/mol
Exact Mass260.14
IUPAC Name1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine
SMILESCC(N)c1ccc(N2CCn3ccnc3C2)c(F)c1
InChIInChI=1S/C14H17FN4/c1-10(16)11-2-3-13(12(15)8-11)19-7-6-18-5-4-17-14(18)9-19/h2-5,8,10H,6-7,9,16H2,1H3
InChIKeyXQUKUGKOBDAYAH-UHFFFAOYSA-N
XLogP2.06
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine?
The IUPAC name of 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine (CID 63014492) is 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine.
What is the SMILES notation for 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine?
The canonical SMILES for 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine is CC(N)c1ccc(N2CCn3ccnc3C2)c(F)c1.
What is the InChIKey of 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine?
The InChIKey is XQUKUGKOBDAYAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4/c1-10(16)11-2-3-13(12(15)8-11)19-7-6-18-5-4-17-14(18)9-19/h2-5,8,10H,6-7,9,16H2,1H3.
What are the key properties of 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine?
1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine has a molecular weight of 260.32 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-fluorophenyl]ethanamine is sourced from PubChem (CID 63014492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).