(NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine

C22H23N3O — CID 139429293

IUPAC(NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine
SMILESO/N=C(/Cc1ccccc1)N1CCC(c2ccnc3ccccc23)CC1
InChIInChI=1S/C22H23N3O/c26-24-22(16-17-6-2-1-3-7-17)25-14-11-18(12-15-25)19-10-13-23-21-9-5-4-8-20(19)21/h1-10,13,18,26H,11-12,14-16H2/b24-22-
InChIKeyVJJGVIOMHWMVGL-GYHWCHFESA-N
MW345.45 g/mol
LogP4.44
Rot. Bonds3

About (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine

(NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine (PubChem CID 139429293) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine
PubChem CID139429293
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC Name(NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine
SMILESO/N=C(/Cc1ccccc1)N1CCC(c2ccnc3ccccc23)CC1
InChIInChI=1S/C22H23N3O/c26-24-22(16-17-6-2-1-3-7-17)25-14-11-18(12-15-25)19-10-13-23-21-9-5-4-8-20(19)21/h1-10,13,18,26H,11-12,14-16H2/b24-22-
InChIKeyVJJGVIOMHWMVGL-GYHWCHFESA-N
XLogP4.44
TPSA48.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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

(NZ)-N-[2-(4-chlorophenyl)-1-(6-quinolin-4-yl-2-azaspiro[3.3]heptan-2-yl)ethylidene]hydroxylamine
CID 156622336
4-cyclopentylquinoline
CID 57273226
(2-ethyl-5-methyl-1,3-oxazol-4-yl)-(4-quinolin-4-ylpiperidin-1-yl)methanone
CID 138035846
N,N-diethyl-4-quinolin-4-ylpiperidine-1-sulfonamide
CID 138029984
[(2R)-1-(quinolin-4-ylmethyl)pyrrolidin-2-yl]methanol
CID 79240208
[1-(quinolin-4-ylmethyl)pyrrolidin-2-yl]methanol
CID 79241362
N-[4-(6-fluoroquinolin-4-yl)cyclohexyl]-2-phenylacetamide
CID 121329944
2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetic acid
CID 138687677
N'-hydroxy-4-(quinolin-4-ylmethyl)morpholine-2-carboximidamide
CID 79670534
3-methyl-2-[[2-(4-quinolin-4-ylcyclohexyl)acetyl]amino]butanoic acid
CID 138680331
4-(6-cyanoquinolin-4-yl)piperidine-1-carboxylic acid
CID 138687738
1-[1-(quinolin-4-ylmethyl)pyrrolidin-2-yl]propan-2-one
CID 79546140

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine (CID 139429293) is (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine is O/N=C(/Cc1ccccc1)N1CCC(c2ccnc3ccccc23)CC1.
What is the InChIKey of (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine?
The InChIKey is VJJGVIOMHWMVGL-GYHWCHFESA-N. The full InChI is InChI=1S/C22H23N3O/c26-24-22(16-17-6-2-1-3-7-17)25-14-11-18(12-15-25)19-10-13-23-21-9-5-4-8-20(19)21/h1-10,13,18,26H,11-12,14-16H2/b24-22-.
What are the key properties of (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine?
(NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine has a molecular weight of 345.45 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[2-phenyl-1-(4-quinolin-4-ylpiperidin-1-yl)ethylidene]hydroxylamine is sourced from PubChem (CID 139429293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).