N-ethenyl-N,N'-dimethylethanimidamide

C6H12N2 — CID 89289021

IUPACN-ethenyl-N,N'-dimethylethanimidamide
SMILESC=CN(C)/C(C)=N/C
InChIInChI=1S/C6H12N2/c1-5-8(4)6(2)7-3/h5H,1H2,2-4H3/b7-6+
InChIKeyBVAWBFAPXVGZCM-VOTSOKGWSA-N
MW112.18 g/mol
LogP1.11
Rot. Bonds1

About N-ethenyl-N,N'-dimethylethanimidamide

N-ethenyl-N,N'-dimethylethanimidamide (PubChem CID 89289021) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is N-ethenyl-N,N'-dimethylethanimidamide.

Molecular Properties

Compound NameN-ethenyl-N,N'-dimethylethanimidamide
PubChem CID89289021
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC NameN-ethenyl-N,N'-dimethylethanimidamide
SMILESC=CN(C)/C(C)=N/C
InChIInChI=1S/C6H12N2/c1-5-8(4)6(2)7-3/h5H,1H2,2-4H3/b7-6+
InChIKeyBVAWBFAPXVGZCM-VOTSOKGWSA-N
XLogP1.11
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 51.11
H-Bond Donors ≤ 50
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-ethenyl-N,N'-dimethylethanimidamide?
The IUPAC name of N-ethenyl-N,N'-dimethylethanimidamide (CID 89289021) is N-ethenyl-N,N'-dimethylethanimidamide.
What is the SMILES notation for N-ethenyl-N,N'-dimethylethanimidamide?
The canonical SMILES for N-ethenyl-N,N'-dimethylethanimidamide is C=CN(C)/C(C)=N/C.
What is the InChIKey of N-ethenyl-N,N'-dimethylethanimidamide?
The InChIKey is BVAWBFAPXVGZCM-VOTSOKGWSA-N. The full InChI is InChI=1S/C6H12N2/c1-5-8(4)6(2)7-3/h5H,1H2,2-4H3/b7-6+.
What are the key properties of N-ethenyl-N,N'-dimethylethanimidamide?
N-ethenyl-N,N'-dimethylethanimidamide has a molecular weight of 112.18 g/mol, XLogP of 1.11, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N,N'-dimethylethanimidamide is sourced from PubChem (CID 89289021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).