(Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide

C11H20N4 — CID 142470329

IUPAC(Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide
SMILESC=CN/C(C)=C(N)/C(N)=N/C=C/CCC
InChIInChI=1S/C11H20N4/c1-4-6-7-8-15-11(13)10(12)9(3)14-5-2/h5,7-8,14H,2,4,6,12H2,1,3H3,(H2,13,15)/b8-7+,10-9-
InChIKeyQFQHXFNQUOEJAC-GOJKSUSPSA-N
MW208.31 g/mol
LogP1.58
Rot. Bonds6

About (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide

(Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide (PubChem CID 142470329) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide.

Molecular Properties

Compound Name(Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide
PubChem CID142470329
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name(Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide
SMILESC=CN/C(C)=C(N)/C(N)=N/C=C/CCC
InChIInChI=1S/C11H20N4/c1-4-6-7-8-15-11(13)10(12)9(3)14-5-2/h5,7-8,14H,2,4,6,12H2,1,3H3,(H2,13,15)/b8-7+,10-9-
InChIKeyQFQHXFNQUOEJAC-GOJKSUSPSA-N
XLogP1.58
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide?
The IUPAC name of (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide (CID 142470329) is (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide.
What is the SMILES notation for (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide?
The canonical SMILES for (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide is C=CN/C(C)=C(N)/C(N)=N/C=C/CCC.
What is the InChIKey of (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide?
The InChIKey is QFQHXFNQUOEJAC-GOJKSUSPSA-N. The full InChI is InChI=1S/C11H20N4/c1-4-6-7-8-15-11(13)10(12)9(3)14-5-2/h5,7-8,14H,2,4,6,12H2,1,3H3,(H2,13,15)/b8-7+,10-9-.
What are the key properties of (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide?
(Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide has a molecular weight of 208.31 g/mol, XLogP of 1.58, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-amino-3-(ethenylamino)-N'-[(E)-pent-1-enyl]but-2-enimidamide is sourced from PubChem (CID 142470329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).