N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide

C10H18N2 — CID 123342837

IUPACN'-butan-2-yl-N-ethenylcyclopropanecarboximidamide
SMILESC=CN/C(=N/C(C)CC)C1CC1
InChIInChI=1S/C10H18N2/c1-4-8(3)12-10(11-5-2)9-6-7-9/h5,8-9H,2,4,6-7H2,1,3H3,(H,11,12)
InChIKeyUHKJEABKBUVHCI-UHFFFAOYSA-N
MW166.27 g/mol
LogP2.33
Rot. Bonds4

About N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide

N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide (PubChem CID 123342837) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-butan-2-yl-N-ethenylcyclopropanecarboximidamide
PubChem CID123342837
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN'-butan-2-yl-N-ethenylcyclopropanecarboximidamide
SMILESC=CN/C(=N/C(C)CC)C1CC1
InChIInChI=1S/C10H18N2/c1-4-8(3)12-10(11-5-2)9-6-7-9/h5,8-9H,2,4,6-7H2,1,3H3,(H,11,12)
InChIKeyUHKJEABKBUVHCI-UHFFFAOYSA-N
XLogP2.33
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.33
H-Bond Donors ≤ 51
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'-butan-2-yl-N-ethenylcyclopropanecarboximidamide?
The IUPAC name of N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide (CID 123342837) is N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide.
What is the SMILES notation for N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide?
The canonical SMILES for N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide is C=CN/C(=N/C(C)CC)C1CC1.
What is the InChIKey of N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide?
The InChIKey is UHKJEABKBUVHCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-4-8(3)12-10(11-5-2)9-6-7-9/h5,8-9H,2,4,6-7H2,1,3H3,(H,11,12).
What are the key properties of N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide?
N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide has a molecular weight of 166.27 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-butan-2-yl-N-ethenylcyclopropanecarboximidamide is sourced from PubChem (CID 123342837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).