3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine

C14H15N7S — CID 67582856

IUPAC3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
SMILESCc1cc(NC2=NC=CN3C2=NCC3c2cnn(C)c2)sn1
InChIInChI=1S/C14H15N7S/c1-9-5-12(22-19-9)18-13-14-16-7-11(21(14)4-3-15-13)10-6-17-20(2)8-10/h3-6,8,11H,7H2,1-2H3,(H,15,18)
InChIKeyXUNNQOYDNQVIQG-UHFFFAOYSA-N
MW313.39 g/mol
LogP1.94
Rot. Bonds2

About 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine

3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine (PubChem CID 67582856) has the molecular formula C14H15N7S and a molecular weight of 313.39 g/mol. Its IUPAC name is 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine.

Molecular Properties

Compound Name3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
PubChem CID67582856
Molecular FormulaC14H15N7S
Molecular Weight313.39 g/mol
Exact Mass313.11
IUPAC Name3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
SMILESCc1cc(NC2=NC=CN3C2=NCC3c2cnn(C)c2)sn1
InChIInChI=1S/C14H15N7S/c1-9-5-12(22-19-9)18-13-14-16-7-11(21(14)4-3-15-13)10-6-17-20(2)8-10/h3-6,8,11H,7H2,1-2H3,(H,15,18)
InChIKeyXUNNQOYDNQVIQG-UHFFFAOYSA-N
XLogP1.94
TPSA70.70 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.39
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
The IUPAC name of 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine (CID 67582856) is 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine.
What is the SMILES notation for 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
The canonical SMILES for 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine is Cc1cc(NC2=NC=CN3C2=NCC3c2cnn(C)c2)sn1.
What is the InChIKey of 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
The InChIKey is XUNNQOYDNQVIQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N7S/c1-9-5-12(22-19-9)18-13-14-16-7-11(21(14)4-3-15-13)10-6-17-20(2)8-10/h3-6,8,11H,7H2,1-2H3,(H,15,18).
What are the key properties of 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine has a molecular weight of 313.39 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine is sourced from PubChem (CID 67582856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).