(NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine

C16H16Cl2N2O2 — CID 139192653

IUPAC(NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine
SMILESO/N=C(\CCl)c1ccccc1.O/N=C(\CCl)c1ccccc1
InChIInChI=1S/2C8H8ClNO/c2*9-6-8(10-11)7-4-2-1-3-5-7/h2*1-5,11H,6H2/b2*10-8+
InChIKeyMLWMCOXRKWNWDW-NYVDXTBYSA-N
MW339.22 g/mol
LogP4.21
Rot. Bonds4

About (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine

(NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine (PubChem CID 139192653) has the molecular formula C16H16Cl2N2O2 and a molecular weight of 339.22 g/mol. Its IUPAC name is (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine
PubChem CID139192653
Molecular FormulaC16H16Cl2N2O2
Molecular Weight339.22 g/mol
Exact Mass338.06
IUPAC Name(NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine
SMILESO/N=C(\CCl)c1ccccc1.O/N=C(\CCl)c1ccccc1
InChIInChI=1S/2C8H8ClNO/c2*9-6-8(10-11)7-4-2-1-3-5-7/h2*1-5,11H,6H2/b2*10-8+
InChIKeyMLWMCOXRKWNWDW-NYVDXTBYSA-N
XLogP4.21
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.22
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(NZ)-N-[2-chloro-1-(4-phenylphenyl)ethylidene]hydroxylamine
CID 125472574
(NZ)-N-[(3E)-3-hydroxyimino-1,3-diphenylpropylidene]hydroxylamine
CID 6297502
N-[2-chloro-1-(4-methylphenyl)ethylidene]hydroxylamine
CID 85344533
copper;2-hydroxyimino-2-phenylethanol
CID 88811267
CID 134863341
CID 134863341
N-[4-[2-(3-chloropropyl)phenyl]-1-phenylbutylidene]hydroxylamine
CID 88690378
acetic acid;2-hydroxyimino-2-phenylethanol
CID 57373390
(NZ)-N-[(5Z)-5-hydroxyimino-1,3,5-triphenylpentylidene]hydroxylamine
CID 74229627
1-[(2Z)-2-hydroxyimino-2-phenylethyl]pyrrolidine-2,5-dione
CID 6420641
N-[2-(3,4-dimethylphenyl)-1-phenylethylidene]hydroxylamine
CID 174958902
(6Z)-6-hydroxyimino-6-phenylhexanoic acid
CID 121009203
(NE)-N-[2-(4-chlorophenyl)sulfanyl-1-phenylethylidene]hydroxylamine
CID 6283022

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine (CID 139192653) is (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine is O/N=C(\CCl)c1ccccc1.O/N=C(\CCl)c1ccccc1.
What is the InChIKey of (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine?
The InChIKey is MLWMCOXRKWNWDW-NYVDXTBYSA-N. The full InChI is InChI=1S/2C8H8ClNO/c2*9-6-8(10-11)7-4-2-1-3-5-7/h2*1-5,11H,6H2/b2*10-8+.
What are the key properties of (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine?
(NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine has a molecular weight of 339.22 g/mol, XLogP of 4.21, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(2-chloro-1-phenylethylidene)hydroxylamine is sourced from PubChem (CID 139192653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).