N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine

C15H22N4O — CID 63025676

IUPACN-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine
SMILESCCNCc1cc(CN2CCn3ccnc3C2)c(C)o1
InChIInChI=1S/C15H22N4O/c1-3-16-9-14-8-13(12(2)20-14)10-18-6-7-19-5-4-17-15(19)11-18/h4-5,8,16H,3,6-7,9-11H2,1-2H3
InChIKeyJMKVCNRAQQJMRT-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.91
Rot. Bonds5

About N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine

N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine (PubChem CID 63025676) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine
PubChem CID63025676
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine
SMILESCCNCc1cc(CN2CCn3ccnc3C2)c(C)o1
InChIInChI=1S/C15H22N4O/c1-3-16-9-14-8-13(12(2)20-14)10-18-6-7-19-5-4-17-15(19)11-18/h4-5,8,16H,3,6-7,9-11H2,1-2H3
InChIKeyJMKVCNRAQQJMRT-UHFFFAOYSA-N
XLogP1.91
TPSA46.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]ethanamine
CID 55143655
5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-2-methylfuran-3-carboxylic acid
CID 63014328
N-[[5-methyl-4-[(3,3,4-trimethylpiperazin-1-yl)methyl]furan-2-yl]methyl]ethanamine
CID 63619652
N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-2-yl]methyl]-2-methylpropan-1-amine
CID 63024993
N-[[5-methyl-4-[(3-methylpyrrolidin-1-yl)methyl]furan-2-yl]methyl]ethanamine
CID 62427660
N-[[1-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethyl]triazol-4-yl]methyl]ethanamine
CID 63024466
N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)thiophen-2-yl]methyl]propan-1-amine
CID 107556729
N-[[5-methyl-4-[(3-propoxypiperidin-1-yl)methyl]furan-2-yl]methyl]ethanamine
CID 62411545
N-[[4-[(3-methoxypiperidin-1-yl)methyl]-5-methylfuran-2-yl]methyl]ethanamine
CID 102968207
N-[[4-[(4-ethylpiperazin-1-yl)methyl]-5-methylfuran-2-yl]methyl]-2-methylpropan-2-amine
CID 62417443
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-N-methylpyridin-2-amine
CID 55145384
N-[[5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)furan-3-yl]methyl]propan-2-amine
CID 63025339

Frequently Asked Questions

What is the IUPAC name of N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine?
The IUPAC name of N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine (CID 63025676) is N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine is CCNCc1cc(CN2CCn3ccnc3C2)c(C)o1.
What is the InChIKey of N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine?
The InChIKey is JMKVCNRAQQJMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-3-16-9-14-8-13(12(2)20-14)10-18-6-7-19-5-4-17-15(19)11-18/h4-5,8,16H,3,6-7,9-11H2,1-2H3.
What are the key properties of N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine?
N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine has a molecular weight of 274.37 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-5-methylfuran-2-yl]methyl]ethanamine is sourced from PubChem (CID 63025676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).