3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine

C10H11N3S — CID 83065242

IUPAC3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine
SMILESCc1nccnc1NCc1ccsc1
InChIInChI=1S/C10H11N3S/c1-8-10(12-4-3-11-8)13-6-9-2-5-14-7-9/h2-5,7H,6H2,1H3,(H,12,13)
InChIKeyCIGWVNNKSFLQIO-UHFFFAOYSA-N
MW205.29 g/mol
LogP2.46
Rot. Bonds3

About 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine

3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine (PubChem CID 83065242) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine
PubChem CID83065242
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine
SMILESCc1nccnc1NCc1ccsc1
InChIInChI=1S/C10H11N3S/c1-8-10(12-4-3-11-8)13-6-9-2-5-14-7-9/h2-5,7H,6H2,1H3,(H,12,13)
InChIKeyCIGWVNNKSFLQIO-UHFFFAOYSA-N
XLogP2.46
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine?
The IUPAC name of 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine (CID 83065242) is 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine.
What is the SMILES notation for 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine?
The canonical SMILES for 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine is Cc1nccnc1NCc1ccsc1.
What is the InChIKey of 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine?
The InChIKey is CIGWVNNKSFLQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c1-8-10(12-4-3-11-8)13-6-9-2-5-14-7-9/h2-5,7H,6H2,1H3,(H,12,13).
What are the key properties of 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine?
3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine has a molecular weight of 205.29 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine is sourced from PubChem (CID 83065242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).