N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine

C15H15N7S — CID 56679966

IUPACN-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine
SMILESCCc1cn2c(-c3cn[nH]c3)cnc2c(Nc2cc(C)ns2)n1
InChIInChI=1S/C15H15N7S/c1-3-11-8-22-12(10-5-17-18-6-10)7-16-15(22)14(19-11)20-13-4-9(2)21-23-13/h4-8H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyQMHMOKUEAXBXGX-UHFFFAOYSA-N
MW325.40 g/mol
LogP3.19
Rot. Bonds4

About N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine

N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine (PubChem CID 56679966) has the molecular formula C15H15N7S and a molecular weight of 325.40 g/mol. Its IUPAC name is N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine.

Molecular Properties

Compound NameN-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine
PubChem CID56679966
Molecular FormulaC15H15N7S
Molecular Weight325.40 g/mol
Exact Mass325.11
IUPAC NameN-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine
SMILESCCc1cn2c(-c3cn[nH]c3)cnc2c(Nc2cc(C)ns2)n1
InChIInChI=1S/C15H15N7S/c1-3-11-8-22-12(10-5-17-18-6-10)7-16-15(22)14(19-11)20-13-4-9(2)21-23-13/h4-8H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyQMHMOKUEAXBXGX-UHFFFAOYSA-N
XLogP3.19
TPSA83.79 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.40
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine?
The IUPAC name of N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine (CID 56679966) is N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine.
What is the SMILES notation for N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine?
The canonical SMILES for N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine is CCc1cn2c(-c3cn[nH]c3)cnc2c(Nc2cc(C)ns2)n1.
What is the InChIKey of N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine?
The InChIKey is QMHMOKUEAXBXGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N7S/c1-3-11-8-22-12(10-5-17-18-6-10)7-16-15(22)14(19-11)20-13-4-9(2)21-23-13/h4-8H,3H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine?
N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine has a molecular weight of 325.40 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-ethyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-methyl-1,2-thiazol-5-amine is sourced from PubChem (CID 56679966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).