8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine

C14H20N4OS — CID 80889678

IUPAC8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCNc1cn2ccnc2c(SC2CCOCC2)n1
InChIInChI=1S/C14H20N4OS/c1-2-5-15-12-10-18-7-6-16-13(18)14(17-12)20-11-3-8-19-9-4-11/h6-7,10-11,15H,2-5,8-9H2,1H3
InChIKeySSSDWRACVZDQMM-UHFFFAOYSA-N
MW292.41 g/mol
LogP2.82
Rot. Bonds5

About 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine

8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine (PubChem CID 80889678) has the molecular formula C14H20N4OS and a molecular weight of 292.41 g/mol. Its IUPAC name is 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine
PubChem CID80889678
Molecular FormulaC14H20N4OS
Molecular Weight292.41 g/mol
Exact Mass292.14
IUPAC Name8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCNc1cn2ccnc2c(SC2CCOCC2)n1
InChIInChI=1S/C14H20N4OS/c1-2-5-15-12-10-18-7-6-16-13(18)14(17-12)20-11-3-8-19-9-4-11/h6-7,10-11,15H,2-5,8-9H2,1H3
InChIKeySSSDWRACVZDQMM-UHFFFAOYSA-N
XLogP2.82
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine (CID 80889678) is 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine is CCCNc1cn2ccnc2c(SC2CCOCC2)n1.
What is the InChIKey of 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine?
The InChIKey is SSSDWRACVZDQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS/c1-2-5-15-12-10-18-7-6-16-13(18)14(17-12)20-11-3-8-19-9-4-11/h6-7,10-11,15H,2-5,8-9H2,1H3.
What are the key properties of 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine?
8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine has a molecular weight of 292.41 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(oxan-4-ylsulfanyl)-N-propylimidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80889678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).