N'-hydroxy-2-quinolin-8-ylethanimidamide

C11H11N3O — CID 53412326

IUPACN'-hydroxy-2-quinolin-8-ylethanimidamide
SMILESNC(Cc1cccc2cccnc12)=NO
InChIInChI=1S/C11H11N3O/c12-10(14-15)7-9-4-1-3-8-5-2-6-13-11(8)9/h1-6,15H,7H2,(H2,12,14)
InChIKeyZPUMORSTVQNUCM-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.52
Rot. Bonds2

About N'-hydroxy-2-quinolin-8-ylethanimidamide

N'-hydroxy-2-quinolin-8-ylethanimidamide (PubChem CID 53412326) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is N'-hydroxy-2-quinolin-8-ylethanimidamide.

Molecular Properties

Compound NameN'-hydroxy-2-quinolin-8-ylethanimidamide
PubChem CID53412326
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC NameN'-hydroxy-2-quinolin-8-ylethanimidamide
SMILESNC(Cc1cccc2cccnc12)=NO
InChIInChI=1S/C11H11N3O/c12-10(14-15)7-9-4-1-3-8-5-2-6-13-11(8)9/h1-6,15H,7H2,(H2,12,14)
InChIKeyZPUMORSTVQNUCM-UHFFFAOYSA-N
XLogP1.52
TPSA71.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.52
H-Bond Donors ≤ 52
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

N'-hydroxy-3-(2-quinolin-8-ylethylamino)propanimidamide
CID 81426159
3-[cyclopropyl(quinolin-8-ylmethyl)amino]-N'-hydroxypropanimidamide
CID 76911837
quinolin-8-ylmethanamine;hydrochloride
CID 50988699
aluminum quinolin-8-ylmethanol
CID 23124809
8-(2-methylprop-2-enyl)quinoline
CID 142452195
N'-hydroxy-1-(quinolin-8-ylmethyl)piperidine-4-carboximidamide
CID 77038510
4-[N-hydroxy-C-(quinolin-8-ylmethyl)carbonimidoyl]benzene-1,3-diol
CID 5213525
ethyl 2-quinolin-8-ylacetate
CID 52562898
2-methyl-1-(2-quinolin-8-ylethyl)guanidine
CID 78989907
1-phenyl-2-quinolin-8-ylethanone
CID 171934139
1-quinolin-8-ylpropan-2-amine
CID 63968867
quinolin-8-ylmethylphosphonic acid
CID 12629202

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2-quinolin-8-ylethanimidamide?
The IUPAC name of N'-hydroxy-2-quinolin-8-ylethanimidamide (CID 53412326) is N'-hydroxy-2-quinolin-8-ylethanimidamide.
What is the SMILES notation for N'-hydroxy-2-quinolin-8-ylethanimidamide?
The canonical SMILES for N'-hydroxy-2-quinolin-8-ylethanimidamide is NC(Cc1cccc2cccnc12)=NO.
What is the InChIKey of N'-hydroxy-2-quinolin-8-ylethanimidamide?
The InChIKey is ZPUMORSTVQNUCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c12-10(14-15)7-9-4-1-3-8-5-2-6-13-11(8)9/h1-6,15H,7H2,(H2,12,14).
What are the key properties of N'-hydroxy-2-quinolin-8-ylethanimidamide?
N'-hydroxy-2-quinolin-8-ylethanimidamide has a molecular weight of 201.23 g/mol, XLogP of 1.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2-quinolin-8-ylethanimidamide is sourced from PubChem (CID 53412326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).