4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine

C10H9N5S — CID 43479059

IUPAC4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine
SMILESCc1cc(N)sc1-c1nnc2cnccn12
InChIInChI=1S/C10H9N5S/c1-6-4-7(11)16-9(6)10-14-13-8-5-12-2-3-15(8)10/h2-5H,11H2,1H3
InChIKeyQYIDUWCIXRAYIY-UHFFFAOYSA-N
MW231.28 g/mol
LogP1.74
Rot. Bonds1

About 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine

4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine (PubChem CID 43479059) has the molecular formula C10H9N5S and a molecular weight of 231.28 g/mol. Its IUPAC name is 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine.

Molecular Properties

Compound Name4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine
PubChem CID43479059
Molecular FormulaC10H9N5S
Molecular Weight231.28 g/mol
Exact Mass231.06
IUPAC Name4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine
SMILESCc1cc(N)sc1-c1nnc2cnccn12
InChIInChI=1S/C10H9N5S/c1-6-4-7(11)16-9(6)10-14-13-8-5-12-2-3-15(8)10/h2-5H,11H2,1H3
InChIKeyQYIDUWCIXRAYIY-UHFFFAOYSA-N
XLogP1.74
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.28
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine?
The IUPAC name of 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine (CID 43479059) is 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine.
What is the SMILES notation for 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine?
The canonical SMILES for 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine is Cc1cc(N)sc1-c1nnc2cnccn12.
What is the InChIKey of 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine?
The InChIKey is QYIDUWCIXRAYIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5S/c1-6-4-7(11)16-9(6)10-14-13-8-5-12-2-3-15(8)10/h2-5H,11H2,1H3.
What are the key properties of 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine?
4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine has a molecular weight of 231.28 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)thiophen-2-amine is sourced from PubChem (CID 43479059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).