N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine

C14H20N4O — CID 55143655

IUPACN-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine
SMILESCCNCc1coc(CN2CCn3ccnc3C2)c1
InChIInChI=1S/C14H20N4O/c1-2-15-8-12-7-13(19-11-12)9-17-5-6-18-4-3-16-14(18)10-17/h3-4,7,11,15H,2,5-6,8-10H2,1H3
InChIKeyPDWUVPNIDSVBLJ-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.60
Rot. Bonds5

About N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine

N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine (PubChem CID 55143655) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine
PubChem CID55143655
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine
SMILESCCNCc1coc(CN2CCn3ccnc3C2)c1
InChIInChI=1S/C14H20N4O/c1-2-15-8-12-7-13(19-11-12)9-17-5-6-18-4-3-16-14(18)10-17/h3-4,7,11,15H,2,5-6,8-10H2,1H3
InChIKeyPDWUVPNIDSVBLJ-UHFFFAOYSA-N
XLogP1.60
TPSA46.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine (CID 55143655) is N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine is CCNCc1coc(CN2CCn3ccnc3C2)c1.
What is the InChIKey of N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine?
The InChIKey is PDWUVPNIDSVBLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-2-15-8-12-7-13(19-11-12)9-17-5-6-18-4-3-16-14(18)10-17/h3-4,7,11,15H,2,5-6,8-10H2,1H3.
What are the key properties of N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine?
N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine has a molecular weight of 260.34 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine is sourced from PubChem (CID 55143655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).