6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine

C9H10N6 — CID 117086808

IUPAC6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine
SMILESCc1cc(N)nc(Nc2cnccn2)n1
InChIInChI=1S/C9H10N6/c1-6-4-7(10)14-9(13-6)15-8-5-11-2-3-12-8/h2-5H,1H3,(H3,10,12,13,14,15)
InChIKeyKSBBJSUSLGLXDS-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.90
Rot. Bonds2

About 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine

6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine (PubChem CID 117086808) has the molecular formula C9H10N6 and a molecular weight of 202.22 g/mol. Its IUPAC name is 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine
PubChem CID117086808
Molecular FormulaC9H10N6
Molecular Weight202.22 g/mol
Exact Mass202.10
IUPAC Name6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine
SMILESCc1cc(N)nc(Nc2cnccn2)n1
InChIInChI=1S/C9H10N6/c1-6-4-7(10)14-9(13-6)15-8-5-11-2-3-12-8/h2-5H,1H3,(H3,10,12,13,14,15)
InChIKeyKSBBJSUSLGLXDS-UHFFFAOYSA-N
XLogP0.90
TPSA89.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine?
The IUPAC name of 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine (CID 117086808) is 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine.
What is the SMILES notation for 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine?
The canonical SMILES for 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine is Cc1cc(N)nc(Nc2cnccn2)n1.
What is the InChIKey of 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine?
The InChIKey is KSBBJSUSLGLXDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6/c1-6-4-7(10)14-9(13-6)15-8-5-11-2-3-12-8/h2-5H,1H3,(H3,10,12,13,14,15).
What are the key properties of 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine?
6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine has a molecular weight of 202.22 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-N-pyrazin-2-ylpyrimidine-2,4-diamine is sourced from PubChem (CID 117086808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).