N'-(ethenylamino)-N,N-dimethylmethanimidamide

C5H11N3 — CID 126494789

IUPACN'-(ethenylamino)-N,N-dimethylmethanimidamide
SMILESC=CN/N=C\N(C)C
InChIInChI=1S/C5H11N3/c1-4-6-7-5-8(2)3/h4-6H,1H2,2-3H3/b7-5-
InChIKeyGGLHWLQIYMVPGJ-ALCCZGGFSA-N
MW113.16 g/mol
LogP0.22
Rot. Bonds3

About N'-(ethenylamino)-N,N-dimethylmethanimidamide

N'-(ethenylamino)-N,N-dimethylmethanimidamide (PubChem CID 126494789) has the molecular formula C5H11N3 and a molecular weight of 113.16 g/mol. Its IUPAC name is N'-(ethenylamino)-N,N-dimethylmethanimidamide.

Molecular Properties

Compound NameN'-(ethenylamino)-N,N-dimethylmethanimidamide
PubChem CID126494789
Molecular FormulaC5H11N3
Molecular Weight113.16 g/mol
Exact Mass113.10
IUPAC NameN'-(ethenylamino)-N,N-dimethylmethanimidamide
SMILESC=CN/N=C\N(C)C
InChIInChI=1S/C5H11N3/c1-4-6-7-5-8(2)3/h4-6H,1H2,2-3H3/b7-5-
InChIKeyGGLHWLQIYMVPGJ-ALCCZGGFSA-N
XLogP0.22
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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'-(ethenylamino)-N,N-dimethylmethanimidamide?
The IUPAC name of N'-(ethenylamino)-N,N-dimethylmethanimidamide (CID 126494789) is N'-(ethenylamino)-N,N-dimethylmethanimidamide.
What is the SMILES notation for N'-(ethenylamino)-N,N-dimethylmethanimidamide?
The canonical SMILES for N'-(ethenylamino)-N,N-dimethylmethanimidamide is C=CN/N=C\N(C)C.
What is the InChIKey of N'-(ethenylamino)-N,N-dimethylmethanimidamide?
The InChIKey is GGLHWLQIYMVPGJ-ALCCZGGFSA-N. The full InChI is InChI=1S/C5H11N3/c1-4-6-7-5-8(2)3/h4-6H,1H2,2-3H3/b7-5-.
What are the key properties of N'-(ethenylamino)-N,N-dimethylmethanimidamide?
N'-(ethenylamino)-N,N-dimethylmethanimidamide has a molecular weight of 113.16 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(ethenylamino)-N,N-dimethylmethanimidamide is sourced from PubChem (CID 126494789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).