2-(dimethyl-λ3-iodanyl)guanidine

C3H10IN3 — CID 144513029

IUPAC2-(dimethyl-λ3-iodanyl)guanidine
SMILESCI(C)N=C(N)N
InChIInChI=1S/C3H10IN3/c1-4(2)7-3(5)6/h1-2H3,(H4,5,6,7)
InChIKeyRERKDIPBOPHUND-UHFFFAOYSA-N
MW215.04 g/mol
LogP-0.06
Rot. Bonds1

About 2-(dimethyl-λ3-iodanyl)guanidine

2-(dimethyl-λ3-iodanyl)guanidine (PubChem CID 144513029) has the molecular formula C3H10IN3 and a molecular weight of 215.04 g/mol. Its IUPAC name is 2-(dimethyl-λ3-iodanyl)guanidine.

Molecular Properties

Compound Name2-(dimethyl-λ3-iodanyl)guanidine
PubChem CID144513029
Molecular FormulaC3H10IN3
Molecular Weight215.04 g/mol
Exact Mass214.99
IUPAC Name2-(dimethyl-λ3-iodanyl)guanidine
SMILESCI(C)N=C(N)N
InChIInChI=1S/C3H10IN3/c1-4(2)7-3(5)6/h1-2H3,(H4,5,6,7)
InChIKeyRERKDIPBOPHUND-UHFFFAOYSA-N
XLogP-0.06
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.04
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethyl-λ3-iodanyl)guanidine?
The IUPAC name of 2-(dimethyl-λ3-iodanyl)guanidine (CID 144513029) is 2-(dimethyl-λ3-iodanyl)guanidine.
What is the SMILES notation for 2-(dimethyl-λ3-iodanyl)guanidine?
The canonical SMILES for 2-(dimethyl-λ3-iodanyl)guanidine is CI(C)N=C(N)N.
What is the InChIKey of 2-(dimethyl-λ3-iodanyl)guanidine?
The InChIKey is RERKDIPBOPHUND-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10IN3/c1-4(2)7-3(5)6/h1-2H3,(H4,5,6,7).
What are the key properties of 2-(dimethyl-λ3-iodanyl)guanidine?
2-(dimethyl-λ3-iodanyl)guanidine has a molecular weight of 215.04 g/mol, XLogP of -0.06, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethyl-λ3-iodanyl)guanidine is sourced from PubChem (CID 144513029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).