(Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide

C10H20N2 — CID 166719458

IUPAC(Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide
SMILESC/C=C(C)\C(N)=N\C(C)C(C)C
InChIInChI=1S/C10H20N2/c1-6-8(4)10(11)12-9(5)7(2)3/h6-7,9H,1-5H3,(H2,11,12)/b8-6-
InChIKeyKPZRYAAKLGCHBG-VURMDHGXSA-N
MW168.28 g/mol
LogP2.35
Rot. Bonds3

About (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide

(Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide (PubChem CID 166719458) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide.

Molecular Properties

Compound Name(Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide
PubChem CID166719458
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide
SMILESC/C=C(C)\C(N)=N\C(C)C(C)C
InChIInChI=1S/C10H20N2/c1-6-8(4)10(11)12-9(5)7(2)3/h6-7,9H,1-5H3,(H2,11,12)/b8-6-
InChIKeyKPZRYAAKLGCHBG-VURMDHGXSA-N
XLogP2.35
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (Z)-2-methyl-N'-(3-methylbutan-2-yl)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-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide?
The IUPAC name of (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide (CID 166719458) is (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide.
What is the SMILES notation for (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide?
The canonical SMILES for (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide is C/C=C(C)\C(N)=N\C(C)C(C)C.
What is the InChIKey of (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide?
The InChIKey is KPZRYAAKLGCHBG-VURMDHGXSA-N. The full InChI is InChI=1S/C10H20N2/c1-6-8(4)10(11)12-9(5)7(2)3/h6-7,9H,1-5H3,(H2,11,12)/b8-6-.
What are the key properties of (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide?
(Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methyl-N'-(3-methylbutan-2-yl)but-2-enimidamide is sourced from PubChem (CID 166719458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).