N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide

C10H16N2 — CID 142396743

IUPACN-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide
SMILESC/C=C\N=C(C)\N=C\C(C)=C/C
InChIInChI=1S/C10H16N2/c1-5-7-11-10(4)12-8-9(3)6-2/h5-8H,1-4H3/b7-5-,9-6-,11-10+,12-8+
InChIKeyOLLRLIPRXMYJFL-SCTGIQMDSA-N
MW164.25 g/mol
LogP2.98
Rot. Bonds2

About N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide

N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide (PubChem CID 142396743) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide.

Molecular Properties

Compound NameN-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide
PubChem CID142396743
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC NameN-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide
SMILESC/C=C\N=C(C)\N=C\C(C)=C/C
InChIInChI=1S/C10H16N2/c1-5-7-11-10(4)12-8-9(3)6-2/h5-8H,1-4H3/b7-5-,9-6-,11-10+,12-8+
InChIKeyOLLRLIPRXMYJFL-SCTGIQMDSA-N
XLogP2.98
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.98
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-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide?
The IUPAC name of N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide (CID 142396743) is N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide.
What is the SMILES notation for N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide?
The canonical SMILES for N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide is C/C=C\N=C(C)\N=C\C(C)=C/C.
What is the InChIKey of N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide?
The InChIKey is OLLRLIPRXMYJFL-SCTGIQMDSA-N. The full InChI is InChI=1S/C10H16N2/c1-5-7-11-10(4)12-8-9(3)6-2/h5-8H,1-4H3/b7-5-,9-6-,11-10+,12-8+.
What are the key properties of N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide?
N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide has a molecular weight of 164.25 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-methylbut-2-enylidene]-N'-[(Z)-prop-1-enyl]ethanimidamide is sourced from PubChem (CID 142396743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).