N-ethenyl-N'-methylhexanimidamide

C9H18N2 — CID 91275682

IUPACN-ethenyl-N'-methylhexanimidamide
SMILESC=CN/C(CCCCC)=N/C
InChIInChI=1S/C9H18N2/c1-4-6-7-8-9(10-3)11-5-2/h5H,2,4,6-8H2,1,3H3,(H,10,11)
InChIKeyVONJZGBAXXZSJV-UHFFFAOYSA-N
MW154.26 g/mol
LogP2.33
Rot. Bonds5

About N-ethenyl-N'-methylhexanimidamide

N-ethenyl-N'-methylhexanimidamide (PubChem CID 91275682) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is N-ethenyl-N'-methylhexanimidamide.

Molecular Properties

Compound NameN-ethenyl-N'-methylhexanimidamide
PubChem CID91275682
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC NameN-ethenyl-N'-methylhexanimidamide
SMILESC=CN/C(CCCCC)=N/C
InChIInChI=1S/C9H18N2/c1-4-6-7-8-9(10-3)11-5-2/h5H,2,4,6-8H2,1,3H3,(H,10,11)
InChIKeyVONJZGBAXXZSJV-UHFFFAOYSA-N
XLogP2.33
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-nonyl-1H-1,3-diazepine
CID 91448328
2-butyl-1-methyl-1H-imidazol-1-ium chloride
CID 66620565
2-butyl-1-methyl-1H-imidazol-1-ium bromide
CID 66620666
2-hexyl-1-methyl-1H-imidazol-1-ium iodide
CID 66652284
2-butyl-1-methyl-1H-imidazol-1-ium iodide
CID 66714320
2-butyl-1-methyl-1H-imidazol-1-ium hydroxide
CID 66932678
1-hexyl-2-methyl-1H-imidazol-1-ium iodide
CID 66955748
2-pentyl-1H-1,3-diazepine
CID 67931914
1-methyl-2-tetradecyl-1H-imidazol-1-ium chloride
CID 68115153
2-butyl-1-ethyl-1H-imidazol-1-ium chloride
CID 68448346
2-hexyl-1-methyl-1H-imidazol-1-ium bromide
CID 68779090
2-decyl-1-methyl-1H-imidazol-1-ium bromide
CID 68784001

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N'-methylhexanimidamide?
The IUPAC name of N-ethenyl-N'-methylhexanimidamide (CID 91275682) is N-ethenyl-N'-methylhexanimidamide.
What is the SMILES notation for N-ethenyl-N'-methylhexanimidamide?
The canonical SMILES for N-ethenyl-N'-methylhexanimidamide is C=CN/C(CCCCC)=N/C.
What is the InChIKey of N-ethenyl-N'-methylhexanimidamide?
The InChIKey is VONJZGBAXXZSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-4-6-7-8-9(10-3)11-5-2/h5H,2,4,6-8H2,1,3H3,(H,10,11).
What are the key properties of N-ethenyl-N'-methylhexanimidamide?
N-ethenyl-N'-methylhexanimidamide has a molecular weight of 154.26 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N'-methylhexanimidamide is sourced from PubChem (CID 91275682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).