N'-amino-N-(ethylamino)ethanimidamide

C4H12N4 — CID 149141171

IUPACN'-amino-N-(ethylamino)ethanimidamide
SMILESCCNNC(C)=NN
InChIInChI=1S/C4H12N4/c1-3-6-8-4(2)7-5/h6H,3,5H2,1-2H3,(H,7,8)
InChIKeyRHUFTNIJZBABLA-UHFFFAOYSA-N
MW116.17 g/mol
LogP-0.61
Rot. Bonds2

About N'-amino-N-(ethylamino)ethanimidamide

N'-amino-N-(ethylamino)ethanimidamide (PubChem CID 149141171) has the molecular formula C4H12N4 and a molecular weight of 116.17 g/mol. Its IUPAC name is N'-amino-N-(ethylamino)ethanimidamide.

Molecular Properties

Compound NameN'-amino-N-(ethylamino)ethanimidamide
PubChem CID149141171
Molecular FormulaC4H12N4
Molecular Weight116.17 g/mol
Exact Mass116.11
IUPAC NameN'-amino-N-(ethylamino)ethanimidamide
SMILESCCNNC(C)=NN
InChIInChI=1S/C4H12N4/c1-3-6-8-4(2)7-5/h6H,3,5H2,1-2H3,(H,7,8)
InChIKeyRHUFTNIJZBABLA-UHFFFAOYSA-N
XLogP-0.61
TPSA62.44 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.17
LogP ≤ 5-0.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-amino-N-(ethylamino)ethanimidamide?
The IUPAC name of N'-amino-N-(ethylamino)ethanimidamide (CID 149141171) is N'-amino-N-(ethylamino)ethanimidamide.
What is the SMILES notation for N'-amino-N-(ethylamino)ethanimidamide?
The canonical SMILES for N'-amino-N-(ethylamino)ethanimidamide is CCNNC(C)=NN.
What is the InChIKey of N'-amino-N-(ethylamino)ethanimidamide?
The InChIKey is RHUFTNIJZBABLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N4/c1-3-6-8-4(2)7-5/h6H,3,5H2,1-2H3,(H,7,8).
What are the key properties of N'-amino-N-(ethylamino)ethanimidamide?
N'-amino-N-(ethylamino)ethanimidamide has a molecular weight of 116.17 g/mol, XLogP of -0.61, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-N-(ethylamino)ethanimidamide is sourced from PubChem (CID 149141171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).