(NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine

C18H17N3O — CID 92527041

IUPAC(NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine
SMILESCc1nccn1[C@@H](/C(=N\O)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H17N3O/c1-14-19-12-13-21(14)18(16-10-6-3-7-11-16)17(20-22)15-8-4-2-5-9-15/h2-13,18,22H,1H3/b20-17-/t18-/m1/s1
InChIKeyHWPPYMYFINLSSO-FBKQIBBUSA-N
MW291.35 g/mol
LogP3.66
Rot. Bonds4

About (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine

(NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine (PubChem CID 92527041) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine
PubChem CID92527041
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC Name(NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine
SMILESCc1nccn1[C@@H](/C(=N\O)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H17N3O/c1-14-19-12-13-21(14)18(16-10-6-3-7-11-16)17(20-22)15-8-4-2-5-9-15/h2-13,18,22H,1H3/b20-17-/t18-/m1/s1
InChIKeyHWPPYMYFINLSSO-FBKQIBBUSA-N
XLogP3.66
TPSA50.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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Related Compounds

2-methyl-1-[(1R)-1-phenylethyl]imidazole
CID 76960079
2-(hydroxymethyl)-3-(2-methylimidazol-1-yl)-3-phenylpropanal
CID 129306742
(NZ)-N-[(2S)-1,2-diphenylpropylidene]hydroxylamine
CID 98569832
3-(2-methylimidazol-1-yl)-3-phenylpropan-1-amine
CID 62780394
3-methyl-2-(2-methylimidazol-1-yl)-1-phenylbutan-1-amine
CID 16784760
2-methyl-1-(1-phenylbut-3-enyl)imidazole
CID 20595483
methyl 2-(4-aminophenyl)-2-(2-methylimidazol-1-yl)acetate
CID 171801445
N-[[1-(2-chlorophenyl)cyclopropyl]methyl]-2-(2-methylimidazol-1-yl)-2-phenylacetamide
CID 46974876
ethyl 2-(4-aminophenyl)-2-(2-methylimidazol-1-yl)acetate
CID 171801216
2-phenyl-1-propan-2-ylimidazole
CID 12997870
N-(2-methylsulfonyl-1,2-diphenylethylidene)hydroxylamine
CID 174925218
N-methyl-2-phenyl-2-(2-phenylimidazol-1-yl)ethanamine
CID 62566802

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine (CID 92527041) is (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine is Cc1nccn1[C@@H](/C(=N\O)c1ccccc1)c1ccccc1.
What is the InChIKey of (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine?
The InChIKey is HWPPYMYFINLSSO-FBKQIBBUSA-N. The full InChI is InChI=1S/C18H17N3O/c1-14-19-12-13-21(14)18(16-10-6-3-7-11-16)17(20-22)15-8-4-2-5-9-15/h2-13,18,22H,1H3/b20-17-/t18-/m1/s1.
What are the key properties of (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine?
(NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine has a molecular weight of 291.35 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(2R)-2-(2-methylimidazol-1-yl)-1,2-diphenylethylidene]hydroxylamine is sourced from PubChem (CID 92527041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).