N-amino-2-ethenylimino-N-methylethanimidamide

C5H10N4 — CID 121299441

IUPACN-amino-2-ethenylimino-N-methylethanimidamide
SMILES[H]/N=C(\C=N\C=C)N(C)N
InChIInChI=1S/C5H10N4/c1-3-8-4-5(6)9(2)7/h3-4,6H,1,7H2,2H3/b6-5+,8-4+
InChIKeyYPBHOMUCGYATJS-PTFSRLPTSA-N
MW126.16 g/mol
LogP-0.02
Rot. Bonds2

About N-amino-2-ethenylimino-N-methylethanimidamide

N-amino-2-ethenylimino-N-methylethanimidamide (PubChem CID 121299441) has the molecular formula C5H10N4 and a molecular weight of 126.16 g/mol. Its IUPAC name is N-amino-2-ethenylimino-N-methylethanimidamide.

Molecular Properties

Compound NameN-amino-2-ethenylimino-N-methylethanimidamide
PubChem CID121299441
Molecular FormulaC5H10N4
Molecular Weight126.16 g/mol
Exact Mass126.09
IUPAC NameN-amino-2-ethenylimino-N-methylethanimidamide
SMILES[H]/N=C(\C=N\C=C)N(C)N
InChIInChI=1S/C5H10N4/c1-3-8-4-5(6)9(2)7/h3-4,6H,1,7H2,2H3/b6-5+,8-4+
InChIKeyYPBHOMUCGYATJS-PTFSRLPTSA-N
XLogP-0.02
TPSA65.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
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-2-ethenylimino-N-methylethanimidamide?
The IUPAC name of N-amino-2-ethenylimino-N-methylethanimidamide (CID 121299441) is N-amino-2-ethenylimino-N-methylethanimidamide.
What is the SMILES notation for N-amino-2-ethenylimino-N-methylethanimidamide?
The canonical SMILES for N-amino-2-ethenylimino-N-methylethanimidamide is [H]/N=C(\C=N\C=C)N(C)N.
What is the InChIKey of N-amino-2-ethenylimino-N-methylethanimidamide?
The InChIKey is YPBHOMUCGYATJS-PTFSRLPTSA-N. The full InChI is InChI=1S/C5H10N4/c1-3-8-4-5(6)9(2)7/h3-4,6H,1,7H2,2H3/b6-5+,8-4+.
What are the key properties of N-amino-2-ethenylimino-N-methylethanimidamide?
N-amino-2-ethenylimino-N-methylethanimidamide has a molecular weight of 126.16 g/mol, XLogP of -0.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-2-ethenylimino-N-methylethanimidamide is sourced from PubChem (CID 121299441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).