N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide

C8H13N3 — CID 130247457

IUPACN,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide
SMILESC=CN(C=C)C(/C=N/C)=N\C
InChIInChI=1S/C8H13N3/c1-5-11(6-2)8(10-4)7-9-3/h5-7H,1-2H2,3-4H3/b9-7+,10-8-
InChIKeyKHAHJXXMFFNGDO-ZWOQCJTASA-N
MW151.21 g/mol
LogP1.30
Rot. Bonds3

About N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide

N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide (PubChem CID 130247457) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide.

Molecular Properties

Compound NameN,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide
PubChem CID130247457
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC NameN,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide
SMILESC=CN(C=C)C(/C=N/C)=N\C
InChIInChI=1S/C8H13N3/c1-5-11(6-2)8(10-4)7-9-3/h5-7H,1-2H2,3-4H3/b9-7+,10-8-
InChIKeyKHAHJXXMFFNGDO-ZWOQCJTASA-N
XLogP1.30
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide?
The IUPAC name of N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide (CID 130247457) is N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide.
What is the SMILES notation for N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide?
The canonical SMILES for N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide is C=CN(C=C)C(/C=N/C)=N\C.
What is the InChIKey of N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide?
The InChIKey is KHAHJXXMFFNGDO-ZWOQCJTASA-N. The full InChI is InChI=1S/C8H13N3/c1-5-11(6-2)8(10-4)7-9-3/h5-7H,1-2H2,3-4H3/b9-7+,10-8-.
What are the key properties of N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide?
N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide has a molecular weight of 151.21 g/mol, XLogP of 1.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(ethenyl)-N'-methyl-2-methyliminoethanimidamide is sourced from PubChem (CID 130247457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).