N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine

C11H21NO — CID 71411342

IUPACN-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine
SMILESCCC(C)=CCC(C)C(CC)=NO
InChIInChI=1S/C11H21NO/c1-5-9(3)7-8-10(4)11(6-2)12-13/h7,10,13H,5-6,8H2,1-4H3
InChIKeyBUQWAARAXGYRLM-UHFFFAOYSA-N
MW183.29 g/mol
LogP3.61
Rot. Bonds5

About N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine

N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine (PubChem CID 71411342) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine
PubChem CID71411342
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine
SMILESCCC(C)=CCC(C)C(CC)=NO
InChIInChI=1S/C11H21NO/c1-5-9(3)7-8-10(4)11(6-2)12-13/h7,10,13H,5-6,8H2,1-4H3
InChIKeyBUQWAARAXGYRLM-UHFFFAOYSA-N
XLogP3.61
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine?
The IUPAC name of N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine (CID 71411342) is N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine.
What is the SMILES notation for N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine?
The canonical SMILES for N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine is CCC(C)=CCC(C)C(CC)=NO.
What is the InChIKey of N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine?
The InChIKey is BUQWAARAXGYRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-5-9(3)7-8-10(4)11(6-2)12-13/h7,10,13H,5-6,8H2,1-4H3.
What are the key properties of N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine?
N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine has a molecular weight of 183.29 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,7-dimethylnon-6-en-3-ylidene)hydroxylamine is sourced from PubChem (CID 71411342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).