N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide

C13H20N4O2 — CID 136990863

IUPACN'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide
SMILESN/C(=N/O)c1ccc(OCCN2CCCCC2)cn1
InChIInChI=1S/C13H20N4O2/c14-13(16-18)12-5-4-11(10-15-12)19-9-8-17-6-2-1-3-7-17/h4-5,10,18H,1-3,6-9H2,(H2,14,16)
InChIKeyFZFCRFOELNEBBG-UHFFFAOYSA-N
MW264.33 g/mol
LogP1.04
Rot. Bonds5

About N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide

N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide (PubChem CID 136990863) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide
PubChem CID136990863
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide
SMILESN/C(=N/O)c1ccc(OCCN2CCCCC2)cn1
InChIInChI=1S/C13H20N4O2/c14-13(16-18)12-5-4-11(10-15-12)19-9-8-17-6-2-1-3-7-17/h4-5,10,18H,1-3,6-9H2,(H2,14,16)
InChIKeyFZFCRFOELNEBBG-UHFFFAOYSA-N
XLogP1.04
TPSA83.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

4-[2-(azepan-1-yl)ethoxy]-N'-hydroxybenzenecarboximidamide
CID 61301567
5-(2-pyrrolidin-1-ylethoxy)pyridine-2-carboxylic acid
CID 79793888
N'-hydroxy-5-(3-piperidin-1-ylpropoxy)pyrimidine-2-carboximidamide
CID 177365400
N'-hydroxy-5-(2-phenoxyethoxy)pyridine-2-carboximidamide
CID 136990781
2-chloro-N'-hydroxy-4-(2-piperidin-1-ylethoxy)benzenecarboximidamide
CID 76981662
5-(2-cyclopropylethoxy)-N'-hydroxypyridine-2-carboximidamide
CID 136731200
N'-hydroxy-5-methoxypyridine-2-carboximidamide
CID 135743705
N'-hydroxy-5-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide
CID 136867042
5-cyclobutyloxy-N'-hydroxypyridine-2-carboximidamide
CID 136990877
4-[2-(azepan-1-yl)ethoxy]benzamide
CID 147487835
N'-hydroxy-5-(1-methylpiperidin-4-yl)oxypyridine-2-carboximidamide
CID 136990869
N-[[4-(2-piperidin-1-ylethoxy)phenyl]methylidene]hydroxylamine
CID 20986071

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide?
The IUPAC name of N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide (CID 136990863) is N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide.
What is the SMILES notation for N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide?
The canonical SMILES for N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide is N/C(=N/O)c1ccc(OCCN2CCCCC2)cn1.
What is the InChIKey of N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide?
The InChIKey is FZFCRFOELNEBBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c14-13(16-18)12-5-4-11(10-15-12)19-9-8-17-6-2-1-3-7-17/h4-5,10,18H,1-3,6-9H2,(H2,14,16).
What are the key properties of N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide?
N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide has a molecular weight of 264.33 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide is sourced from PubChem (CID 136990863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).