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

C14H15N7S — CID 143464914

IUPACN-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
SMILESCN1C=C(c2cnc3c(Nc4ccns4)nccn23)CN1C
InChIInChI=1S/C14H15N7S/c1-19-8-10(9-20(19)2)11-7-16-14-13(15-5-6-21(11)14)18-12-3-4-17-22-12/h3-8H,9H2,1-2H3,(H,15,18)
InChIKeyCAXLVWKWDVYIPP-UHFFFAOYSA-N
MW313.39 g/mol
LogP2.06
Rot. Bonds3

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

N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine (PubChem CID 143464914) has the molecular formula C14H15N7S and a molecular weight of 313.39 g/mol. Its IUPAC name is N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine.

Molecular Properties

Compound NameN-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
PubChem CID143464914
Molecular FormulaC14H15N7S
Molecular Weight313.39 g/mol
Exact Mass313.11
IUPAC NameN-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine
SMILESCN1C=C(c2cnc3c(Nc4ccns4)nccn23)CN1C
InChIInChI=1S/C14H15N7S/c1-19-8-10(9-20(19)2)11-7-16-14-13(15-5-6-21(11)14)18-12-3-4-17-22-12/h3-8H,9H2,1-2H3,(H,15,18)
InChIKeyCAXLVWKWDVYIPP-UHFFFAOYSA-N
XLogP2.06
TPSA61.59 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.39
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
The IUPAC name of N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine (CID 143464914) is N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine.
What is the SMILES notation for N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
The canonical SMILES for N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine is CN1C=C(c2cnc3c(Nc4ccns4)nccn23)CN1C.
What is the InChIKey of N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
The InChIKey is CAXLVWKWDVYIPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N7S/c1-19-8-10(9-20(19)2)11-7-16-14-13(15-5-6-21(11)14)18-12-3-4-17-22-12/h3-8H,9H2,1-2H3,(H,15,18).
What are the key properties of N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine?
N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine has a molecular weight of 313.39 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1,2-dimethyl-3H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine is sourced from PubChem (CID 143464914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).