N-(aminomethylidene)methanimidamide;ethane

C6H17N3 — CID 142058983

IUPACN-(aminomethylidene)methanimidamide;ethane
SMILESCC.CC.[H]/N=C/N=C/N
InChIInChI=1S/C2H5N3.2C2H6/c3-1-5-2-4;2*1-2/h1-2H,(H3,3,4,5);2*1-2H3
InChIKeyQQYDOLLPTIVZKE-UHFFFAOYSA-N
MW131.22 g/mol
LogP1.63
Rot. Bonds1

About N-(aminomethylidene)methanimidamide;ethane

N-(aminomethylidene)methanimidamide;ethane (PubChem CID 142058983) has the molecular formula C6H17N3 and a molecular weight of 131.22 g/mol. Its IUPAC name is N-(aminomethylidene)methanimidamide;ethane.

Molecular Properties

Compound NameN-(aminomethylidene)methanimidamide;ethane
PubChem CID142058983
Molecular FormulaC6H17N3
Molecular Weight131.22 g/mol
Exact Mass131.14
IUPAC NameN-(aminomethylidene)methanimidamide;ethane
SMILESCC.CC.[H]/N=C/N=C/N
InChIInChI=1S/C2H5N3.2C2H6/c3-1-5-2-4;2*1-2/h1-2H,(H3,3,4,5);2*1-2H3
InChIKeyQQYDOLLPTIVZKE-UHFFFAOYSA-N
XLogP1.63
TPSA62.23 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 51.63
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 142058983) 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.CC.[H]/N=C/N=C/N.
What is the InChIKey of N-(aminomethylidene)methanimidamide;ethane?
The InChIKey is QQYDOLLPTIVZKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5N3.2C2H6/c3-1-5-2-4;2*1-2/h1-2H,(H3,3,4,5);2*1-2H3.
What are the key properties of N-(aminomethylidene)methanimidamide;ethane?
N-(aminomethylidene)methanimidamide;ethane has a molecular weight of 131.22 g/mol, XLogP of 1.63, 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 142058983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).