2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine

C16H14N4S2 — CID 95802645

IUPAC2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
SMILESCc1ccc(-c2nc3cnccn3c2NCc2cccs2)s1
InChIInChI=1S/C16H14N4S2/c1-11-4-5-13(22-11)15-16(18-9-12-3-2-8-21-12)20-7-6-17-10-14(20)19-15/h2-8,10,18H,9H2,1H3
InChIKeyWCDUXBRMWXPURM-UHFFFAOYSA-N
MW326.45 g/mol
LogP4.44
Rot. Bonds4

About 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine

2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine (PubChem CID 95802645) has the molecular formula C16H14N4S2 and a molecular weight of 326.45 g/mol. Its IUPAC name is 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound Name2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
PubChem CID95802645
Molecular FormulaC16H14N4S2
Molecular Weight326.45 g/mol
Exact Mass326.07
IUPAC Name2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
SMILESCc1ccc(-c2nc3cnccn3c2NCc2cccs2)s1
InChIInChI=1S/C16H14N4S2/c1-11-4-5-13(22-11)15-16(18-9-12-3-2-8-21-12)20-7-6-17-10-14(20)19-15/h2-8,10,18H,9H2,1H3
InChIKeyWCDUXBRMWXPURM-UHFFFAOYSA-N
XLogP4.44
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.45
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-pyridin-3-yl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
CID 46952213
2-[2-(dimethylamino)pyrimidin-5-yl]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine
CID 95802748
4-[3-(thiophen-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]benzene-1,2-diol
CID 135674296
N-(furan-2-ylmethyl)-2-thiophen-2-ylimidazo[1,2-a]pyrazin-3-amine
CID 95802609
N-tert-butyl-2-[5-(2-thiophen-2-ylethynyl)thiophen-2-yl]imidazo[1,2-a]pyrazin-3-amine;hydrochloride
CID 69322196
2-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyrazin-3-amine
CID 16668400
N-tert-butyl-2-[5-(2-thiophen-3-ylethynyl)thiophen-2-yl]imidazo[1,2-a]pyrazin-3-amine
CID 69322640
N-benzyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
CID 808655
3-methyl-N-(thiophen-2-ylmethyl)-1,2,4-oxadiazol-5-amine
CID 115777298
N-[(4-fluorophenyl)methyl]-2-(furan-2-yl)imidazo[1,2-a]pyrazin-3-amine
CID 16674805
N-tert-butyl-2-[5-[2-(2-fluorophenyl)ethynyl]thiophen-2-yl]imidazo[1,2-a]pyrazin-3-amine;hydrochloride
CID 69322336
4-N-ethyl-6-imidazol-1-yl-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80770959

Frequently Asked Questions

What is the IUPAC name of 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine (CID 95802645) is 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine is Cc1ccc(-c2nc3cnccn3c2NCc2cccs2)s1.
What is the InChIKey of 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
The InChIKey is WCDUXBRMWXPURM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4S2/c1-11-4-5-13(22-11)15-16(18-9-12-3-2-8-21-12)20-7-6-17-10-14(20)19-15/h2-8,10,18H,9H2,1H3.
What are the key properties of 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine?
2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine has a molecular weight of 326.45 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylthiophen-2-yl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 95802645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).