O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine

C8H17NO — CID 174159134

IUPACO-(3,4-dimethylhex-2-en-2-yl)hydroxylamine
SMILESCCC(C)C(C)=C(C)ON
InChIInChI=1S/C8H17NO/c1-5-6(2)7(3)8(4)10-9/h6H,5,9H2,1-4H3
InChIKeyPZFJAVQSQRVTNJ-UHFFFAOYSA-N
MW143.23 g/mol
LogP2.22
Rot. Bonds3

About O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine

O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine (PubChem CID 174159134) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine.

Molecular Properties

Compound NameO-(3,4-dimethylhex-2-en-2-yl)hydroxylamine
PubChem CID174159134
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameO-(3,4-dimethylhex-2-en-2-yl)hydroxylamine
SMILESCCC(C)C(C)=C(C)ON
InChIInChI=1S/C8H17NO/c1-5-6(2)7(3)8(4)10-9/h6H,5,9H2,1-4H3
InChIKeyPZFJAVQSQRVTNJ-UHFFFAOYSA-N
XLogP2.22
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', '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 O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine?
The IUPAC name of O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine (CID 174159134) is O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine.
What is the SMILES notation for O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine?
The canonical SMILES for O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine is CCC(C)C(C)=C(C)ON.
What is the InChIKey of O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine?
The InChIKey is PZFJAVQSQRVTNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-5-6(2)7(3)8(4)10-9/h6H,5,9H2,1-4H3.
What are the key properties of O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine?
O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine has a molecular weight of 143.23 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-(3,4-dimethylhex-2-en-2-yl)hydroxylamine is sourced from PubChem (CID 174159134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).