(Z)-3-amino-N',2-dimethylbut-2-enimidamide

C6H13N3 — CID 90367835

IUPAC(Z)-3-amino-N',2-dimethylbut-2-enimidamide
SMILESC/N=C(N)/C(C)=C(/C)N
InChIInChI=1S/C6H13N3/c1-4(5(2)7)6(8)9-3/h7H2,1-3H3,(H2,8,9)/b5-4-
InChIKeyGNHBOGNNDXMCCI-PLNGDYQASA-N
MW127.19 g/mol
LogP0.23
Rot. Bonds1

About (Z)-3-amino-N',2-dimethylbut-2-enimidamide

(Z)-3-amino-N',2-dimethylbut-2-enimidamide (PubChem CID 90367835) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is (Z)-3-amino-N',2-dimethylbut-2-enimidamide.

Molecular Properties

Compound Name(Z)-3-amino-N',2-dimethylbut-2-enimidamide
PubChem CID90367835
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC Name(Z)-3-amino-N',2-dimethylbut-2-enimidamide
SMILESC/N=C(N)/C(C)=C(/C)N
InChIInChI=1S/C6H13N3/c1-4(5(2)7)6(8)9-3/h7H2,1-3H3,(H2,8,9)/b5-4-
InChIKeyGNHBOGNNDXMCCI-PLNGDYQASA-N
XLogP0.23
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z)-3-amino-N',2-dimethylbut-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)-3-amino-N',2-dimethylbut-2-enimidamide?
The IUPAC name of (Z)-3-amino-N',2-dimethylbut-2-enimidamide (CID 90367835) is (Z)-3-amino-N',2-dimethylbut-2-enimidamide.
What is the SMILES notation for (Z)-3-amino-N',2-dimethylbut-2-enimidamide?
The canonical SMILES for (Z)-3-amino-N',2-dimethylbut-2-enimidamide is C/N=C(N)/C(C)=C(/C)N.
What is the InChIKey of (Z)-3-amino-N',2-dimethylbut-2-enimidamide?
The InChIKey is GNHBOGNNDXMCCI-PLNGDYQASA-N. The full InChI is InChI=1S/C6H13N3/c1-4(5(2)7)6(8)9-3/h7H2,1-3H3,(H2,8,9)/b5-4-.
What are the key properties of (Z)-3-amino-N',2-dimethylbut-2-enimidamide?
(Z)-3-amino-N',2-dimethylbut-2-enimidamide has a molecular weight of 127.19 g/mol, XLogP of 0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-N',2-dimethylbut-2-enimidamide is sourced from PubChem (CID 90367835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).