8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine

C13H20N4S — CID 80887812

IUPAC8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCNc1cn2ccnc2c(SC(C)(C)C)n1
InChIInChI=1S/C13H20N4S/c1-5-6-14-10-9-17-8-7-15-11(17)12(16-10)18-13(2,3)4/h7-9,14H,5-6H2,1-4H3
InChIKeyQPQIOOPEOABGCD-UHFFFAOYSA-N
MW264.40 g/mol
LogP3.44
Rot. Bonds4

About 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine

8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine (PubChem CID 80887812) has the molecular formula C13H20N4S and a molecular weight of 264.40 g/mol. Its IUPAC name is 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine
PubChem CID80887812
Molecular FormulaC13H20N4S
Molecular Weight264.40 g/mol
Exact Mass264.14
IUPAC Name8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCNc1cn2ccnc2c(SC(C)(C)C)n1
InChIInChI=1S/C13H20N4S/c1-5-6-14-10-9-17-8-7-15-11(17)12(16-10)18-13(2,3)4/h7-9,14H,5-6H2,1-4H3
InChIKeyQPQIOOPEOABGCD-UHFFFAOYSA-N
XLogP3.44
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.40
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

8-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80888691
8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80889678
8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80883484
8-butylsulfanyl-N-ethylimidazo[1,2-a]pyrazin-6-amine
CID 80885141
6-N,8-N,8-N-tripropylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80764672
8-N-methyl-8-N-(2-methylbutan-2-yl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80839758
N-ethyl-8-propan-2-ylsulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80885373
N-ethyl-8-(2-methylpropylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 80893173
8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80842087
2-methyl-1-[[6-(propylamino)imidazo[1,2-a]pyrazin-8-yl]amino]butan-2-ol
CID 80842987
8-imidazol-1-yl-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80854230
N-ethyl-8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 107765896

Frequently Asked Questions

What is the IUPAC name of 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine (CID 80887812) is 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine is CCCNc1cn2ccnc2c(SC(C)(C)C)n1.
What is the InChIKey of 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine?
The InChIKey is QPQIOOPEOABGCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4S/c1-5-6-14-10-9-17-8-7-15-11(17)12(16-10)18-13(2,3)4/h7-9,14H,5-6H2,1-4H3.
What are the key properties of 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine?
8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine has a molecular weight of 264.40 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80887812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).