2-ethylguanidine;2-methylguanidine

C5H16N6 — CID 158740686

IUPAC2-ethylguanidine;2-methylguanidine
SMILESCCN=C(N)N.CN=C(N)N
InChIInChI=1S/C3H9N3.C2H7N3/c1-2-6-3(4)5;1-5-2(3)4/h2H2,1H3,(H4,4,5,6);1H3,(H4,3,4,5)
InChIKeyIMGIALBITFIYNH-UHFFFAOYSA-N
MW160.22 g/mol
LogP-1.83
Rot. Bonds1

About 2-ethylguanidine;2-methylguanidine

2-ethylguanidine;2-methylguanidine (PubChem CID 158740686) has the molecular formula C5H16N6 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2-ethylguanidine;2-methylguanidine.

Molecular Properties

Compound Name2-ethylguanidine;2-methylguanidine
PubChem CID158740686
Molecular FormulaC5H16N6
Molecular Weight160.22 g/mol
Exact Mass160.14
IUPAC Name2-ethylguanidine;2-methylguanidine
SMILESCCN=C(N)N.CN=C(N)N
InChIInChI=1S/C3H9N3.C2H7N3/c1-2-6-3(4)5;1-5-2(3)4/h2H2,1H3,(H4,4,5,6);1H3,(H4,3,4,5)
InChIKeyIMGIALBITFIYNH-UHFFFAOYSA-N
XLogP-1.83
TPSA128.80 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-1.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethylguanidine;2-methylguanidine?
The IUPAC name of 2-ethylguanidine;2-methylguanidine (CID 158740686) is 2-ethylguanidine;2-methylguanidine.
What is the SMILES notation for 2-ethylguanidine;2-methylguanidine?
The canonical SMILES for 2-ethylguanidine;2-methylguanidine is CCN=C(N)N.CN=C(N)N.
What is the InChIKey of 2-ethylguanidine;2-methylguanidine?
The InChIKey is IMGIALBITFIYNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N3.C2H7N3/c1-2-6-3(4)5;1-5-2(3)4/h2H2,1H3,(H4,4,5,6);1H3,(H4,3,4,5).
What are the key properties of 2-ethylguanidine;2-methylguanidine?
2-ethylguanidine;2-methylguanidine has a molecular weight of 160.22 g/mol, XLogP of -1.83, 1 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylguanidine;2-methylguanidine is sourced from PubChem (CID 158740686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).