N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine

C11H19NO — CID 135271646

IUPACN-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine
SMILESC=C(CCC(=C)C(=C)C(C)C)NO
InChIInChI=1S/C11H19NO/c1-8(2)11(5)9(3)6-7-10(4)12-13/h8,12-13H,3-7H2,1-2H3
InChIKeyWVTCCSXVTTXFJC-UHFFFAOYSA-N
MW181.28 g/mol
LogP3.03
Rot. Bonds6

About N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine

N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine (PubChem CID 135271646) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine.

Molecular Properties

Compound NameN-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine
PubChem CID135271646
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC NameN-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine
SMILESC=C(CCC(=C)C(=C)C(C)C)NO
InChIInChI=1S/C11H19NO/c1-8(2)11(5)9(3)6-7-10(4)12-13/h8,12-13H,3-7H2,1-2H3
InChIKeyWVTCCSXVTTXFJC-UHFFFAOYSA-N
XLogP3.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine?
The IUPAC name of N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine (CID 135271646) is N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine.
What is the SMILES notation for N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine?
The canonical SMILES for N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine is C=C(CCC(=C)C(=C)C(C)C)NO.
What is the InChIKey of N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine?
The InChIKey is WVTCCSXVTTXFJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-8(2)11(5)9(3)6-7-10(4)12-13/h8,12-13H,3-7H2,1-2H3.
What are the key properties of N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine?
N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine has a molecular weight of 181.28 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methyl-5,6-dimethylideneoct-1-en-2-yl)hydroxylamine is sourced from PubChem (CID 135271646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).