N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide

C14H28N2 — CID 138630196

IUPACN'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide
SMILESC/C=C(\N/C=N/C)C(C)(C)CC(C)C(C)C
InChIInChI=1S/C14H28N2/c1-8-13(16-10-15-7)14(5,6)9-12(4)11(2)3/h8,10-12H,9H2,1-7H3,(H,15,16)/b13-8-
InChIKeyOLQPIPRIZFHXFY-JYRVWZFOSA-N
MW224.39 g/mol
LogP3.85
Rot. Bonds6

About N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide

N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide (PubChem CID 138630196) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide.

Molecular Properties

Compound NameN'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide
PubChem CID138630196
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide
SMILESC/C=C(\N/C=N/C)C(C)(C)CC(C)C(C)C
InChIInChI=1S/C14H28N2/c1-8-13(16-10-15-7)14(5,6)9-12(4)11(2)3/h8,10-12H,9H2,1-7H3,(H,15,16)/b13-8-
InChIKeyOLQPIPRIZFHXFY-JYRVWZFOSA-N
XLogP3.85
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 53.85
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'}

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Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide?
The IUPAC name of N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide (CID 138630196) is N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide.
What is the SMILES notation for N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide?
The canonical SMILES for N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide is C/C=C(\N/C=N/C)C(C)(C)CC(C)C(C)C.
What is the InChIKey of N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide?
The InChIKey is OLQPIPRIZFHXFY-JYRVWZFOSA-N. The full InChI is InChI=1S/C14H28N2/c1-8-13(16-10-15-7)14(5,6)9-12(4)11(2)3/h8,10-12H,9H2,1-7H3,(H,15,16)/b13-8-.
What are the key properties of N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide?
N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide has a molecular weight of 224.39 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-[(Z)-4,4,6,7-tetramethyloct-2-en-3-yl]methanimidamide is sourced from PubChem (CID 138630196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).