N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide

C7H14N2O — CID 134344133

IUPACN'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide
SMILESC/C=C(\O/N=C\N)C(C)C
InChIInChI=1S/C7H14N2O/c1-4-7(6(2)3)10-9-5-8/h4-6H,1-3H3,(H2,8,9)/b7-4-
InChIKeyQWVYMDLQJQJWOF-DAXSKMNVSA-N
MW142.20 g/mol
LogP1.46
Rot. Bonds3

About N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide

N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide (PubChem CID 134344133) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide.

Molecular Properties

Compound NameN'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide
PubChem CID134344133
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide
SMILESC/C=C(\O/N=C\N)C(C)C
InChIInChI=1S/C7H14N2O/c1-4-7(6(2)3)10-9-5-8/h4-6H,1-3H3,(H2,8,9)/b7-4-
InChIKeyQWVYMDLQJQJWOF-DAXSKMNVSA-N
XLogP1.46
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', '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'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide?
The IUPAC name of N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide (CID 134344133) is N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide.
What is the SMILES notation for N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide?
The canonical SMILES for N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide is C/C=C(\O/N=C\N)C(C)C.
What is the InChIKey of N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide?
The InChIKey is QWVYMDLQJQJWOF-DAXSKMNVSA-N. The full InChI is InChI=1S/C7H14N2O/c1-4-7(6(2)3)10-9-5-8/h4-6H,1-3H3,(H2,8,9)/b7-4-.
What are the key properties of N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide?
N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide has a molecular weight of 142.20 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-4-methylpent-2-en-3-yl]oxymethanimidamide is sourced from PubChem (CID 134344133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).