3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine

C11H15N5 — CID 103007712

IUPAC3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine
SMILESCc1nccnc1NCCc1ccnn1C
InChIInChI=1S/C11H15N5/c1-9-11(14-8-7-12-9)13-5-3-10-4-6-15-16(10)2/h4,6-8H,3,5H2,1-2H3,(H,13,14)
InChIKeyVSUDOBPPDXBBGT-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.17
Rot. Bonds4

About 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine

3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine (PubChem CID 103007712) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine.

Molecular Properties

Compound Name3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine
PubChem CID103007712
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine
SMILESCc1nccnc1NCCc1ccnn1C
InChIInChI=1S/C11H15N5/c1-9-11(14-8-7-12-9)13-5-3-10-4-6-15-16(10)2/h4,6-8H,3,5H2,1-2H3,(H,13,14)
InChIKeyVSUDOBPPDXBBGT-UHFFFAOYSA-N
XLogP1.17
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine?
The IUPAC name of 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine (CID 103007712) is 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine.
What is the SMILES notation for 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine?
The canonical SMILES for 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine is Cc1nccnc1NCCc1ccnn1C.
What is the InChIKey of 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine?
The InChIKey is VSUDOBPPDXBBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-9-11(14-8-7-12-9)13-5-3-10-4-6-15-16(10)2/h4,6-8H,3,5H2,1-2H3,(H,13,14).
What are the key properties of 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine?
3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine has a molecular weight of 217.28 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrazin-2-amine is sourced from PubChem (CID 103007712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).