N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide

C5H8N4 — CID 142562215

IUPACN-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide
SMILESC=CN(N)/C(C#N)=N/C
InChIInChI=1S/C5H8N4/c1-3-9(7)5(4-6)8-2/h3H,1,7H2,2H3/b8-5+
InChIKeyGOSWKIPGKICEJA-VMPITWQZSA-N
MW124.15 g/mol
LogP-0.14
Rot. Bonds1

About N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide

N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide (PubChem CID 142562215) has the molecular formula C5H8N4 and a molecular weight of 124.15 g/mol. Its IUPAC name is N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide.

Molecular Properties

Compound NameN-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide
PubChem CID142562215
Molecular FormulaC5H8N4
Molecular Weight124.15 g/mol
Exact Mass124.07
IUPAC NameN-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide
SMILESC=CN(N)/C(C#N)=N/C
InChIInChI=1S/C5H8N4/c1-3-9(7)5(4-6)8-2/h3H,1,7H2,2H3/b8-5+
InChIKeyGOSWKIPGKICEJA-VMPITWQZSA-N
XLogP-0.14
TPSA65.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.15
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide?
The IUPAC name of N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide (CID 142562215) is N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide.
What is the SMILES notation for N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide?
The canonical SMILES for N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide is C=CN(N)/C(C#N)=N/C.
What is the InChIKey of N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide?
The InChIKey is GOSWKIPGKICEJA-VMPITWQZSA-N. The full InChI is InChI=1S/C5H8N4/c1-3-9(7)5(4-6)8-2/h3H,1,7H2,2H3/b8-5+.
What are the key properties of N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide?
N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide has a molecular weight of 124.15 g/mol, XLogP of -0.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-1-cyano-N-ethenyl-N'-methylmethanimidamide is sourced from PubChem (CID 142562215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).