N-(aminomethylidene)methanimidamide;ethane

C4H11N3 — CID 144534962

IUPACN-(aminomethylidene)methanimidamide;ethane
SMILESCC.[H]/N=C/N=C/N
InChIInChI=1S/C2H5N3.C2H6/c3-1-5-2-4;1-2/h1-2H,(H3,3,4,5);1-2H3
InChIKeySSMDGGZDDZNPRY-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.61
Rot. Bonds1

About N-(aminomethylidene)methanimidamide;ethane

N-(aminomethylidene)methanimidamide;ethane (PubChem CID 144534962) has the molecular formula C4H11N3 and a molecular weight of 101.15 g/mol. Its IUPAC name is N-(aminomethylidene)methanimidamide;ethane.

Molecular Properties

Compound NameN-(aminomethylidene)methanimidamide;ethane
PubChem CID144534962
Molecular FormulaC4H11N3
Molecular Weight101.15 g/mol
Exact Mass101.10
IUPAC NameN-(aminomethylidene)methanimidamide;ethane
SMILESCC.[H]/N=C/N=C/N
InChIInChI=1S/C2H5N3.C2H6/c3-1-5-2-4;1-2/h1-2H,(H3,3,4,5);1-2H3
InChIKeySSMDGGZDDZNPRY-UHFFFAOYSA-N
XLogP0.61
TPSA62.23 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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 N-(aminomethylidene)methanimidamide;ethane?
The IUPAC name of N-(aminomethylidene)methanimidamide;ethane (CID 144534962) is N-(aminomethylidene)methanimidamide;ethane.
What is the SMILES notation for N-(aminomethylidene)methanimidamide;ethane?
The canonical SMILES for N-(aminomethylidene)methanimidamide;ethane is CC.[H]/N=C/N=C/N.
What is the InChIKey of N-(aminomethylidene)methanimidamide;ethane?
The InChIKey is SSMDGGZDDZNPRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5N3.C2H6/c3-1-5-2-4;1-2/h1-2H,(H3,3,4,5);1-2H3.
What are the key properties of N-(aminomethylidene)methanimidamide;ethane?
N-(aminomethylidene)methanimidamide;ethane has a molecular weight of 101.15 g/mol, XLogP of 0.61, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(aminomethylidene)methanimidamide;ethane is sourced from PubChem (CID 144534962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).