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

C17H21N5OS — CID 97467609

IUPAC1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine
SMILESCN(Cc1cn2c(n1)CN(Cc1nccs1)CC2)Cc1ccco1
InChIInChI=1S/C17H21N5OS/c1-20(11-15-3-2-7-23-15)9-14-10-22-6-5-21(12-16(22)19-14)13-17-18-4-8-24-17/h2-4,7-8,10H,5-6,9,11-13H2,1H3
InChIKeyCZLCJAJHQBSIQA-UHFFFAOYSA-N
MW343.46 g/mol
LogP2.58
Rot. Bonds6

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

1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine (PubChem CID 97467609) has the molecular formula C17H21N5OS and a molecular weight of 343.46 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine
PubChem CID97467609
Molecular FormulaC17H21N5OS
Molecular Weight343.46 g/mol
Exact Mass343.15
IUPAC Name1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine
SMILESCN(Cc1cn2c(n1)CN(Cc1nccs1)CC2)Cc1ccco1
InChIInChI=1S/C17H21N5OS/c1-20(11-15-3-2-7-23-15)9-14-10-22-6-5-21(12-16(22)19-14)13-17-18-4-8-24-17/h2-4,7-8,10H,5-6,9,11-13H2,1H3
InChIKeyCZLCJAJHQBSIQA-UHFFFAOYSA-N
XLogP2.58
TPSA50.33 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.46
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine?
The IUPAC name of 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine (CID 97467609) is 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine.
What is the SMILES notation for 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine?
The canonical SMILES for 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine is CN(Cc1cn2c(n1)CN(Cc1nccs1)CC2)Cc1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine?
The InChIKey is CZLCJAJHQBSIQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5OS/c1-20(11-15-3-2-7-23-15)9-14-10-22-6-5-21(12-16(22)19-14)13-17-18-4-8-24-17/h2-4,7-8,10H,5-6,9,11-13H2,1H3.
What are the key properties of 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine?
1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine has a molecular weight of 343.46 g/mol, XLogP of 2.58, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-methyl-N-[[7-(1,3-thiazol-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]methanamine is sourced from PubChem (CID 97467609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).