6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine

C15H19N5S — CID 80836799

IUPAC6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(N(C)CCc2cccs2)n1
InChIInChI=1S/C15H19N5S/c1-3-16-13-11-20-9-7-17-14(20)15(18-13)19(2)8-6-12-5-4-10-21-12/h4-5,7,9-11,16H,3,6,8H2,1-2H3
InChIKeyZKJMDOWQPUDVAH-UHFFFAOYSA-N
MW301.42 g/mol
LogP2.90
Rot. Bonds6

About 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine

6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80836799) has the molecular formula C15H19N5S and a molecular weight of 301.42 g/mol. Its IUPAC name is 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80836799
Molecular FormulaC15H19N5S
Molecular Weight301.42 g/mol
Exact Mass301.14
IUPAC Name6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCNc1cn2ccnc2c(N(C)CCc2cccs2)n1
InChIInChI=1S/C15H19N5S/c1-3-16-13-11-20-9-7-17-14(20)15(18-13)19(2)8-6-12-5-4-10-21-12/h4-5,7,9-11,16H,3,6,8H2,1-2H3
InChIKeyZKJMDOWQPUDVAH-UHFFFAOYSA-N
XLogP2.90
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-N-ethyl-8-N-methyl-8-N-(2-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80838608
6-N,8-N-diethyl-8-N-(furan-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80780048
8-N-ethyl-8-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80798910
8-N-cyclopentyl-6-N-ethyl-8-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80775064
6-N-ethyl-8-N-methyl-8-N-[(1-methylpyrrolidin-2-yl)methyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80836320
6-N-methyl-8-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80772084
N-methyl-8-(thiophen-2-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80872591
N-ethyl-8-(1,3-thiazol-2-ylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 80886588
2-N-ethyl-6-N-methyl-6-N-(2-thiophen-2-ylethyl)-7H-purine-2,6-diamine
CID 114785619
6-hydrazinyl-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
CID 80943622
3-[ethyl-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylpropanenitrile
CID 80806075
N-ethyl-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80886756

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 80836799) is 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine is CCNc1cn2ccnc2c(N(C)CCc2cccs2)n1.
What is the InChIKey of 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is ZKJMDOWQPUDVAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5S/c1-3-16-13-11-20-9-7-17-14(20)15(18-13)19(2)8-6-12-5-4-10-21-12/h4-5,7,9-11,16H,3,6,8H2,1-2H3.
What are the key properties of 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine?
6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 301.42 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-8-N-methyl-8-N-(2-thiophen-2-ylethyl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80836799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).