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

C16H17N7S — CID 71195330

IUPAC3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
SMILESCn1cc(C2CN=C3C(Nc4cc(C5CC5)ns4)=NC=CN32)cn1
InChIInChI=1S/C16H17N7S/c1-22-9-11(7-19-22)13-8-18-16-15(17-4-5-23(13)16)20-14-6-12(21-24-14)10-2-3-10/h4-7,9-10,13H,2-3,8H2,1H3,(H,17,20)
InChIKeyWGLCKSXXJMRWQF-UHFFFAOYSA-N
MW339.43 g/mol
LogP2.50
Rot. Bonds3

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

3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine (PubChem CID 71195330) has the molecular formula C16H17N7S and a molecular weight of 339.43 g/mol. Its IUPAC name is 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
PubChem CID71195330
Molecular FormulaC16H17N7S
Molecular Weight339.43 g/mol
Exact Mass339.13
IUPAC Name3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
SMILESCn1cc(C2CN=C3C(Nc4cc(C5CC5)ns4)=NC=CN32)cn1
InChIInChI=1S/C16H17N7S/c1-22-9-11(7-19-22)13-8-18-16-15(17-4-5-23(13)16)20-14-6-12(21-24-14)10-2-3-10/h4-7,9-10,13H,2-3,8H2,1H3,(H,17,20)
InChIKeyWGLCKSXXJMRWQF-UHFFFAOYSA-N
XLogP2.50
TPSA70.70 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.43
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-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-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine (CID 71195330) is 3-cyclopropyl-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-cyclopropyl-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-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine is Cn1cc(C2CN=C3C(Nc4cc(C5CC5)ns4)=NC=CN32)cn1.
What is the InChIKey of 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
The InChIKey is WGLCKSXXJMRWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N7S/c1-22-9-11(7-19-22)13-8-18-16-15(17-4-5-23(13)16)20-14-6-12(21-24-14)10-2-3-10/h4-7,9-10,13H,2-3,8H2,1H3,(H,17,20).
What are the key properties of 3-cyclopropyl-N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
3-cyclopropyl-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 339.43 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-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 71195330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).