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

C14H14N6S — CID 67583490

IUPAC3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine
SMILESCn1cc(C2CN=C3C(Nc4cccs4)=NC=CN32)cn1
InChIInChI=1S/C14H14N6S/c1-19-9-10(7-17-19)11-8-16-14-13(15-4-5-20(11)14)18-12-3-2-6-21-12/h2-7,9,11H,8H2,1H3,(H,15,18)
InChIKeyBQORGQMRGDQSQU-UHFFFAOYSA-N
MW298.38 g/mol
LogP2.23
Rot. Bonds2

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

3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine (PubChem CID 67583490) has the molecular formula C14H14N6S and a molecular weight of 298.38 g/mol. Its IUPAC name is 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine
PubChem CID67583490
Molecular FormulaC14H14N6S
Molecular Weight298.38 g/mol
Exact Mass298.10
IUPAC Name3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine
SMILESCn1cc(C2CN=C3C(Nc4cccs4)=NC=CN32)cn1
InChIInChI=1S/C14H14N6S/c1-19-9-10(7-17-19)11-8-16-14-13(15-4-5-20(11)14)18-12-3-2-6-21-12/h2-7,9,11H,8H2,1H3,(H,15,18)
InChIKeyBQORGQMRGDQSQU-UHFFFAOYSA-N
XLogP2.23
TPSA57.81 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine (CID 67583490) is 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine is Cn1cc(C2CN=C3C(Nc4cccs4)=NC=CN32)cn1.
What is the InChIKey of 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is BQORGQMRGDQSQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6S/c1-19-9-10(7-17-19)11-8-16-14-13(15-4-5-20(11)14)18-12-3-2-6-21-12/h2-7,9,11H,8H2,1H3,(H,15,18).
What are the key properties of 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine?
3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 298.38 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-4-yl)-N-thiophen-2-yl-2,3-dihydroimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 67583490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).