(NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine

C15H23NO — CID 102526050

IUPAC(NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine
SMILESC/C1=C\CC(C)(C)/C=C/C(=N/O)/C(C)=C/CC1
InChIInChI=1S/C15H23NO/c1-12-6-5-7-13(2)14(16-17)9-11-15(3,4)10-8-12/h7-9,11,17H,5-6,10H2,1-4H3/b11-9+,12-8+,13-7+,16-14-
InChIKeyLFYBEOFGXZIKBH-AZDZXSNSSA-N
MW233.35 g/mol
LogP4.48
Rot. Bonds

About (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine

(NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine (PubChem CID 102526050) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine
PubChem CID102526050
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name(NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine
SMILESC/C1=C\CC(C)(C)/C=C/C(=N/O)/C(C)=C/CC1
InChIInChI=1S/C15H23NO/c1-12-6-5-7-13(2)14(16-17)9-11-15(3,4)10-8-12/h7-9,11,17H,5-6,10H2,1-4H3/b11-9+,12-8+,13-7+,16-14-
InChIKeyLFYBEOFGXZIKBH-AZDZXSNSSA-N
XLogP4.48
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 54.48
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 (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine (CID 102526050) is (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine is C/C1=C\CC(C)(C)/C=C/C(=N/O)/C(C)=C/CC1.
What is the InChIKey of (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine?
The InChIKey is LFYBEOFGXZIKBH-AZDZXSNSSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-6-5-7-13(2)14(16-17)9-11-15(3,4)10-8-12/h7-9,11,17H,5-6,10H2,1-4H3/b11-9+,12-8+,13-7+,16-14-.
What are the key properties of (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine?
(NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine has a molecular weight of 233.35 g/mol, XLogP of 4.48, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-ylidene]hydroxylamine is sourced from PubChem (CID 102526050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).