(Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide

C7H16N4 — CID 144534927

IUPAC(Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide
SMILESCCN/C(C)=C(N)/C(N)=N/C
InChIInChI=1S/C7H16N4/c1-4-11-5(2)6(8)7(9)10-3/h11H,4,8H2,1-3H3,(H2,9,10)/b6-5-
InChIKeyRLYLYPAQFPGFGM-WAYWQWQTSA-N
MW156.23 g/mol
LogP-0.23
Rot. Bonds3

About (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide

(Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide (PubChem CID 144534927) has the molecular formula C7H16N4 and a molecular weight of 156.23 g/mol. Its IUPAC name is (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide.

Molecular Properties

Compound Name(Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide
PubChem CID144534927
Molecular FormulaC7H16N4
Molecular Weight156.23 g/mol
Exact Mass156.14
IUPAC Name(Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide
SMILESCCN/C(C)=C(N)/C(N)=N/C
InChIInChI=1S/C7H16N4/c1-4-11-5(2)6(8)7(9)10-3/h11H,4,8H2,1-3H3,(H2,9,10)/b6-5-
InChIKeyRLYLYPAQFPGFGM-WAYWQWQTSA-N
XLogP-0.23
TPSA76.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.23
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'}

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Related Compounds

(Z)-3-amino-2-(2-aminoethylamino)-N'-ethenylbut-2-enimidamide
CID 89682228
(Z)-3-amino-N,N'-dimethyl-2-(methylideneamino)but-2-enimidamide
CID 143940343
[(Z)-1,2-diamino-3-(ethylamino)but-2-enylidene]-methylazanium
CID 144534926
[4-Amino-3-[(methylideneamino)methylideneamino]but-2-en-2-yl]-methylazanium
CID 163800896
(Z)-2-amino-N'-(methylaminomethyl)-3-[methyl(propan-2-yl)amino]but-2-enimidamide
CID 164112756
(E)-3-amino-N-ethylidene-N'-methyl-2-(methylamino)but-2-enimidamide
CID 164856656
(Z)-2,3-diamino-N'-methylbut-2-enimidamide
CID 167237416
N'-[1-amino-3-(methylamino)but-2-en-2-yl]-N-methylidenemethanimidamide
CID 163800897

Frequently Asked Questions

What is the IUPAC name of (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide?
The IUPAC name of (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide (CID 144534927) is (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide.
What is the SMILES notation for (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide?
The canonical SMILES for (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide is CCN/C(C)=C(N)/C(N)=N/C.
What is the InChIKey of (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide?
The InChIKey is RLYLYPAQFPGFGM-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H16N4/c1-4-11-5(2)6(8)7(9)10-3/h11H,4,8H2,1-3H3,(H2,9,10)/b6-5-.
What are the key properties of (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide?
(Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide has a molecular weight of 156.23 g/mol, XLogP of -0.23, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-amino-3-(ethylamino)-N'-methylbut-2-enimidamide is sourced from PubChem (CID 144534927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).