(Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide

C11H24N4 — CID 155586195

IUPAC(Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide
SMILESCN(C)CC/N=C(N)/C=C(\N)C(C)(C)C
InChIInChI=1S/C11H24N4/c1-11(2,3)9(12)8-10(13)14-6-7-15(4)5/h8H,6-7,12H2,1-5H3,(H2,13,14)/b9-8-
InChIKeyZQNFHWVCWLBPLN-HJWRWDBZSA-N
MW212.34 g/mol
LogP0.79
Rot. Bonds4

About (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide

(Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide (PubChem CID 155586195) has the molecular formula C11H24N4 and a molecular weight of 212.34 g/mol. Its IUPAC name is (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide.

Molecular Properties

Compound Name(Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide
PubChem CID155586195
Molecular FormulaC11H24N4
Molecular Weight212.34 g/mol
Exact Mass212.20
IUPAC Name(Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide
SMILESCN(C)CC/N=C(N)/C=C(\N)C(C)(C)C
InChIInChI=1S/C11H24N4/c1-11(2,3)9(12)8-10(13)14-6-7-15(4)5/h8H,6-7,12H2,1-5H3,(H2,13,14)/b9-8-
InChIKeyZQNFHWVCWLBPLN-HJWRWDBZSA-N
XLogP0.79
TPSA67.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.79
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide?
The IUPAC name of (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide (CID 155586195) is (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide.
What is the SMILES notation for (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide?
The canonical SMILES for (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide is CN(C)CC/N=C(N)/C=C(\N)C(C)(C)C.
What is the InChIKey of (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide?
The InChIKey is ZQNFHWVCWLBPLN-HJWRWDBZSA-N. The full InChI is InChI=1S/C11H24N4/c1-11(2,3)9(12)8-10(13)14-6-7-15(4)5/h8H,6-7,12H2,1-5H3,(H2,13,14)/b9-8-.
What are the key properties of (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide?
(Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide has a molecular weight of 212.34 g/mol, XLogP of 0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-N'-[2-(dimethylamino)ethyl]-4,4-dimethylpent-2-enimidamide is sourced from PubChem (CID 155586195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).