3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine

C19H18N4O2S — CID 25205361

IUPAC3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(-c2cnc3c(NCc4cccs4)nccn23)cc1OC
InChIInChI=1S/C19H18N4O2S/c1-24-16-6-5-13(10-17(16)25-2)15-12-22-19-18(20-7-8-23(15)19)21-11-14-4-3-9-26-14/h3-10,12H,11H2,1-2H3,(H,20,21)
InChIKeyXHDHYNBSILQNCJ-UHFFFAOYSA-N
MW366.45 g/mol
LogP4.09
Rot. Bonds6

About 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine

3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 25205361) has the molecular formula C19H18N4O2S and a molecular weight of 366.45 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID25205361
Molecular FormulaC19H18N4O2S
Molecular Weight366.45 g/mol
Exact Mass366.12
IUPAC Name3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(-c2cnc3c(NCc4cccs4)nccn23)cc1OC
InChIInChI=1S/C19H18N4O2S/c1-24-16-6-5-13(10-17(16)25-2)15-12-22-19-18(20-7-8-23(15)19)21-11-14-4-3-9-26-14/h3-10,12H,11H2,1-2H3,(H,20,21)
InChIKeyXHDHYNBSILQNCJ-UHFFFAOYSA-N
XLogP4.09
TPSA60.68 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.45
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3-(4-fluorophenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]imidazo[1,2-a]pyrazin-8-amine
CID 126472520
3-[[[3-(4-hydroxy-3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide
CID 135931682
2-methoxy-5-[8-[(4-methylsulfonylphenyl)methylamino]imidazo[1,2-a]pyrazin-3-yl]phenol
CID 143766243
3-(3-fluoro-4-methoxyphenyl)-N-methylimidazo[1,2-a]pyrazin-8-amine
CID 58777802
N-[4-[[[3-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]phenyl]methanesulfonamide
CID 89431321
N-[3-[8-[(3,4,5-trimethoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-3-yl]phenyl]acetamide
CID 126472344
N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine;4-[[[3-(3-cyano-4-hydroxyphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzenesulfonamide;3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;4-[[[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzoic acid;4-[[(3-phenylimidazo[1,2-a]pyrazin-8-yl)amino]methyl]benzenesulfonamide;4-[8-(pyridin-3-ylmethylamino)imidazo[1,2-a]pyrazin-3-yl]phenol
CID 158890061
N-[(3-chlorophenyl)methyl]-3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 25205191
N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 46241898
N-(3-phenylpropyl)-5-(3,4,5-trimethoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 126475213
1-methyl-3-(thiophen-2-ylmethylamino)pyrazin-2-one
CID 62939218
N-(pyridin-4-ylmethyl)-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-8-amine
CID 126472930

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine (CID 25205361) is 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine is COc1ccc(-c2cnc3c(NCc4cccs4)nccn23)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is XHDHYNBSILQNCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2S/c1-24-16-6-5-13(10-17(16)25-2)15-12-22-19-18(20-7-8-23(15)19)21-11-14-4-3-9-26-14/h3-10,12H,11H2,1-2H3,(H,20,21).
What are the key properties of 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 366.45 g/mol, XLogP of 4.09, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 25205361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).