(NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine

C13H14ClNO — CID 5375595

IUPAC(NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine
SMILESO/N=C1/CCCC/C1=C/c1ccccc1Cl
InChIInChI=1S/C13H14ClNO/c14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)15-16/h1,3,5,7,9,16H,2,4,6,8H2/b11-9-,15-13-
InChIKeyYIUNSWVHBJKYGU-CLHOCLAASA-N
MW235.71 g/mol
LogP4.13
Rot. Bonds1

About (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine

(NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine (PubChem CID 5375595) has the molecular formula C13H14ClNO and a molecular weight of 235.71 g/mol. Its IUPAC name is (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine
PubChem CID5375595
Molecular FormulaC13H14ClNO
Molecular Weight235.71 g/mol
Exact Mass235.08
IUPAC Name(NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine
SMILESO/N=C1/CCCC/C1=C/c1ccccc1Cl
InChIInChI=1S/C13H14ClNO/c14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)15-16/h1,3,5,7,9,16H,2,4,6,8H2/b11-9-,15-13-
InChIKeyYIUNSWVHBJKYGU-CLHOCLAASA-N
XLogP4.13
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.71
LogP ≤ 54.13
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-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine (CID 5375595) is (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine is O/N=C1/CCCC/C1=C/c1ccccc1Cl.
What is the InChIKey of (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine?
The InChIKey is YIUNSWVHBJKYGU-CLHOCLAASA-N. The full InChI is InChI=1S/C13H14ClNO/c14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)15-16/h1,3,5,7,9,16H,2,4,6,8H2/b11-9-,15-13-.
What are the key properties of (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine?
(NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine has a molecular weight of 235.71 g/mol, XLogP of 4.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(2Z)-2-[(2-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine is sourced from PubChem (CID 5375595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).