N'-amino-N-ethenyl-N-methylmethanimidamide

C4H9N3 — CID 91499866

IUPACN'-amino-N-ethenyl-N-methylmethanimidamide
SMILESC=CN(C)C=NN
InChIInChI=1S/C4H9N3/c1-3-7(2)4-6-5/h3-4H,1,5H2,2H3
InChIKeyMDNZZFBAQOVGQI-UHFFFAOYSA-N
MW99.14 g/mol
LogP-0.04
Rot. Bonds2

About N'-amino-N-ethenyl-N-methylmethanimidamide

N'-amino-N-ethenyl-N-methylmethanimidamide (PubChem CID 91499866) has the molecular formula C4H9N3 and a molecular weight of 99.14 g/mol. Its IUPAC name is N'-amino-N-ethenyl-N-methylmethanimidamide.

Molecular Properties

Compound NameN'-amino-N-ethenyl-N-methylmethanimidamide
PubChem CID91499866
Molecular FormulaC4H9N3
Molecular Weight99.14 g/mol
Exact Mass99.08
IUPAC NameN'-amino-N-ethenyl-N-methylmethanimidamide
SMILESC=CN(C)C=NN
InChIInChI=1S/C4H9N3/c1-3-7(2)4-6-5/h3-4H,1,5H2,2H3
InChIKeyMDNZZFBAQOVGQI-UHFFFAOYSA-N
XLogP-0.04
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.14
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-N-ethenyl-N-methylmethanimidamide?
The IUPAC name of N'-amino-N-ethenyl-N-methylmethanimidamide (CID 91499866) is N'-amino-N-ethenyl-N-methylmethanimidamide.
What is the SMILES notation for N'-amino-N-ethenyl-N-methylmethanimidamide?
The canonical SMILES for N'-amino-N-ethenyl-N-methylmethanimidamide is C=CN(C)C=NN.
What is the InChIKey of N'-amino-N-ethenyl-N-methylmethanimidamide?
The InChIKey is MDNZZFBAQOVGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N3/c1-3-7(2)4-6-5/h3-4H,1,5H2,2H3.
What are the key properties of N'-amino-N-ethenyl-N-methylmethanimidamide?
N'-amino-N-ethenyl-N-methylmethanimidamide has a molecular weight of 99.14 g/mol, XLogP of -0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-N-ethenyl-N-methylmethanimidamide is sourced from PubChem (CID 91499866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).