N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide

C15H24N2 — CID 118616765

IUPACN-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide
SMILESCC/C=C(/C=N/C(=N\C)C1C=CCCC1)CC
InChIInChI=1S/C15H24N2/c1-4-9-13(5-2)12-17-15(16-3)14-10-7-6-8-11-14/h7,9-10,12,14H,4-6,8,11H2,1-3H3/b13-9+,16-15-,17-12+
InChIKeyYKRQVCBXDGXXDO-XRJSGCKSSA-N
MW232.37 g/mol
LogP4.19
Rot. Bonds4

About N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide

N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide (PubChem CID 118616765) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide.

Molecular Properties

Compound NameN-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide
PubChem CID118616765
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide
SMILESCC/C=C(/C=N/C(=N\C)C1C=CCCC1)CC
InChIInChI=1S/C15H24N2/c1-4-9-13(5-2)12-17-15(16-3)14-10-7-6-8-11-14/h7,9-10,12,14H,4-6,8,11H2,1-3H3/b13-9+,16-15-,17-12+
InChIKeyYKRQVCBXDGXXDO-XRJSGCKSSA-N
XLogP4.19
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.19
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide?
The IUPAC name of N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide (CID 118616765) is N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide.
What is the SMILES notation for N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide?
The canonical SMILES for N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide is CC/C=C(/C=N/C(=N\C)C1C=CCCC1)CC.
What is the InChIKey of N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide?
The InChIKey is YKRQVCBXDGXXDO-XRJSGCKSSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-9-13(5-2)12-17-15(16-3)14-10-7-6-8-11-14/h7,9-10,12,14H,4-6,8,11H2,1-3H3/b13-9+,16-15-,17-12+.
What are the key properties of N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide?
N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide has a molecular weight of 232.37 g/mol, XLogP of 4.19, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-2-ethylpent-2-enylidene]-N'-methylcyclohex-2-ene-1-carboximidamide is sourced from PubChem (CID 118616765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).