(NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine

C11H11NO — CID 102428373

IUPAC(NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine
SMILESO/N=C1/CCC=C1c1ccccc1
InChIInChI=1S/C11H11NO/c13-12-11-8-4-7-10(11)9-5-2-1-3-6-9/h1-3,5-7,13H,4,8H2/b12-11-
InChIKeyIQHLWGNCEOQYNC-QXMHVHEDSA-N
MW173.22 g/mol
LogP2.69
Rot. Bonds1

About (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine

(NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine (PubChem CID 102428373) has the molecular formula C11H11NO and a molecular weight of 173.22 g/mol. Its IUPAC name is (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine
PubChem CID102428373
Molecular FormulaC11H11NO
Molecular Weight173.22 g/mol
Exact Mass173.08
IUPAC Name(NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine
SMILESO/N=C1/CCC=C1c1ccccc1
InChIInChI=1S/C11H11NO/c13-12-11-8-4-7-10(11)9-5-2-1-3-6-9/h1-3,5-7,13H,4,8H2/b12-11-
InChIKeyIQHLWGNCEOQYNC-QXMHVHEDSA-N
XLogP2.69
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 52.69
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-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine (CID 102428373) is (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine is O/N=C1/CCC=C1c1ccccc1.
What is the InChIKey of (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine?
The InChIKey is IQHLWGNCEOQYNC-QXMHVHEDSA-N. The full InChI is InChI=1S/C11H11NO/c13-12-11-8-4-7-10(11)9-5-2-1-3-6-9/h1-3,5-7,13H,4,8H2/b12-11-.
What are the key properties of (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine?
(NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine has a molecular weight of 173.22 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(2-phenylcyclopent-2-en-1-ylidene)hydroxylamine is sourced from PubChem (CID 102428373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).