8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine

C11H16N4S — CID 107766025

IUPAC8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
SMILESCC(C)CCSc1nc(N)cn2ccnc12
InChIInChI=1S/C11H16N4S/c1-8(2)3-6-16-11-10-13-4-5-15(10)7-9(12)14-11/h4-5,7-8H,3,6,12H2,1-2H3
InChIKeyFICRCOYDDCTFKI-UHFFFAOYSA-N
MW236.34 g/mol
LogP2.45
Rot. Bonds4

About 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine

8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 107766025) has the molecular formula C11H16N4S and a molecular weight of 236.34 g/mol. Its IUPAC name is 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
PubChem CID107766025
Molecular FormulaC11H16N4S
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC Name8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
SMILESCC(C)CCSc1nc(N)cn2ccnc12
InChIInChI=1S/C11H16N4S/c1-8(2)3-6-16-11-10-13-4-5-15(10)7-9(12)14-11/h4-5,7-8H,3,6,12H2,1-2H3
InChIKeyFICRCOYDDCTFKI-UHFFFAOYSA-N
XLogP2.45
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine (CID 107766025) is 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine is CC(C)CCSc1nc(N)cn2ccnc12.
What is the InChIKey of 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is FICRCOYDDCTFKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4S/c1-8(2)3-6-16-11-10-13-4-5-15(10)7-9(12)14-11/h4-5,7-8H,3,6,12H2,1-2H3.
What are the key properties of 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine?
8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 236.34 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 107766025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).