(1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium

C6H15N4+ — CID 22965554

IUPAC(1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium
SMILESCN1CCN(N)C1=[N+](C)C
InChIInChI=1S/C6H15N4/c1-8(2)6-9(3)4-5-10(6)7/h4-5,7H2,1-3H3/q+1
InChIKeyWCELRGONPZTHCP-UHFFFAOYSA-N
MW143.21 g/mol
LogP-1.26
Rot. Bonds

About (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium

(1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium (PubChem CID 22965554) has the molecular formula C6H15N4+ and a molecular weight of 143.21 g/mol. Its IUPAC name is (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium.

Molecular Properties

Compound Name(1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium
PubChem CID22965554
Molecular FormulaC6H15N4+
Molecular Weight143.21 g/mol
Exact Mass143.13
IUPAC Name(1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium
SMILESCN1CCN(N)C1=[N+](C)C
InChIInChI=1S/C6H15N4/c1-8(2)6-9(3)4-5-10(6)7/h4-5,7H2,1-3H3/q+1
InChIKeyWCELRGONPZTHCP-UHFFFAOYSA-N
XLogP-1.26
TPSA35.51 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 5-1.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium?
The IUPAC name of (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium (CID 22965554) is (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium.
What is the SMILES notation for (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium?
The canonical SMILES for (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium is CN1CCN(N)C1=[N+](C)C.
What is the InChIKey of (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium?
The InChIKey is WCELRGONPZTHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N4/c1-8(2)6-9(3)4-5-10(6)7/h4-5,7H2,1-3H3/q+1.
What are the key properties of (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium?
(1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium has a molecular weight of 143.21 g/mol, XLogP of -1.26, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-amino-3-methylimidazolidin-2-ylidene)-dimethylazanium is sourced from PubChem (CID 22965554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).