2-ethylpyrimidine-4,6-diamine

C6H10N4 — CID 45080086

IUPAC2-ethylpyrimidine-4,6-diamine
SMILESCCc1nc(N)cc(N)n1
InChIInChI=1S/C6H10N4/c1-2-6-9-4(7)3-5(8)10-6/h3H,2H2,1H3,(H4,7,8,9,10)
InChIKeyXLLIULZWETUHFA-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.20
Rot. Bonds1

About 2-ethylpyrimidine-4,6-diamine

2-ethylpyrimidine-4,6-diamine (PubChem CID 45080086) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-ethylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name2-ethylpyrimidine-4,6-diamine
PubChem CID45080086
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name2-ethylpyrimidine-4,6-diamine
SMILESCCc1nc(N)cc(N)n1
InChIInChI=1S/C6H10N4/c1-2-6-9-4(7)3-5(8)10-6/h3H,2H2,1H3,(H4,7,8,9,10)
InChIKeyXLLIULZWETUHFA-UHFFFAOYSA-N
XLogP0.20
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethylpyrimidine-4,6-diamine?
The IUPAC name of 2-ethylpyrimidine-4,6-diamine (CID 45080086) is 2-ethylpyrimidine-4,6-diamine.
What is the SMILES notation for 2-ethylpyrimidine-4,6-diamine?
The canonical SMILES for 2-ethylpyrimidine-4,6-diamine is CCc1nc(N)cc(N)n1.
What is the InChIKey of 2-ethylpyrimidine-4,6-diamine?
The InChIKey is XLLIULZWETUHFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4/c1-2-6-9-4(7)3-5(8)10-6/h3H,2H2,1H3,(H4,7,8,9,10).
What are the key properties of 2-ethylpyrimidine-4,6-diamine?
2-ethylpyrimidine-4,6-diamine has a molecular weight of 138.17 g/mol, XLogP of 0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylpyrimidine-4,6-diamine is sourced from PubChem (CID 45080086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).