N-ethenyl-N,N'-dimethylpropanimidamide

C7H14N2 — CID 134554083

IUPACN-ethenyl-N,N'-dimethylpropanimidamide
SMILESC=CN(C)/C(CC)=N/C
InChIInChI=1S/C7H14N2/c1-5-7(8-3)9(4)6-2/h6H,2,5H2,1,3-4H3/b8-7+
InChIKeyAPWIXSDYPIRSGQ-BQYQJAHWSA-N
MW126.20 g/mol
LogP1.50
Rot. Bonds2

About N-ethenyl-N,N'-dimethylpropanimidamide

N-ethenyl-N,N'-dimethylpropanimidamide (PubChem CID 134554083) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N-ethenyl-N,N'-dimethylpropanimidamide.

Molecular Properties

Compound NameN-ethenyl-N,N'-dimethylpropanimidamide
PubChem CID134554083
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN-ethenyl-N,N'-dimethylpropanimidamide
SMILESC=CN(C)/C(CC)=N/C
InChIInChI=1S/C7H14N2/c1-5-7(8-3)9(4)6-2/h6H,2,5H2,1,3-4H3/b8-7+
InChIKeyAPWIXSDYPIRSGQ-BQYQJAHWSA-N
XLogP1.50
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.50
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'-dimethylpropanimidamide?
The IUPAC name of N-ethenyl-N,N'-dimethylpropanimidamide (CID 134554083) is N-ethenyl-N,N'-dimethylpropanimidamide.
What is the SMILES notation for N-ethenyl-N,N'-dimethylpropanimidamide?
The canonical SMILES for N-ethenyl-N,N'-dimethylpropanimidamide is C=CN(C)/C(CC)=N/C.
What is the InChIKey of N-ethenyl-N,N'-dimethylpropanimidamide?
The InChIKey is APWIXSDYPIRSGQ-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H14N2/c1-5-7(8-3)9(4)6-2/h6H,2,5H2,1,3-4H3/b8-7+.
What are the key properties of N-ethenyl-N,N'-dimethylpropanimidamide?
N-ethenyl-N,N'-dimethylpropanimidamide has a molecular weight of 126.20 g/mol, XLogP of 1.50, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N,N'-dimethylpropanimidamide is sourced from PubChem (CID 134554083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).