(NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine

C7H15NO — CID 5359479

IUPAC(NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine
SMILESC/C(CCC(C)C)=N/O
InChIInChI=1S/C7H15NO/c1-6(2)4-5-7(3)8-9/h6,9H,4-5H2,1-3H3/b8-7-
InChIKeyZVZUNLVAVHYXNI-FPLPWBNLSA-N
MW129.20 g/mol
LogP2.27
Rot. Bonds3

About (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine

(NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine (PubChem CID 5359479) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine
PubChem CID5359479
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name(NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine
SMILESC/C(CCC(C)C)=N/O
InChIInChI=1S/C7H15NO/c1-6(2)4-5-7(3)8-9/h6,9H,4-5H2,1-3H3/b8-7-
InChIKeyZVZUNLVAVHYXNI-FPLPWBNLSA-N
XLogP2.27
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', '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 (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine (CID 5359479) is (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine is C/C(CCC(C)C)=N/O.
What is the InChIKey of (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine?
The InChIKey is ZVZUNLVAVHYXNI-FPLPWBNLSA-N. The full InChI is InChI=1S/C7H15NO/c1-6(2)4-5-7(3)8-9/h6,9H,4-5H2,1-3H3/b8-7-.
What are the key properties of (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine?
(NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine has a molecular weight of 129.20 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(5-methylhexan-2-ylidene)hydroxylamine is sourced from PubChem (CID 5359479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).