N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide

C13H20N4O2 — CID 24696730

IUPACN'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide
SMILESN/C(=N\O)c1ccc(N2CCCCC2CCO)nc1
InChIInChI=1S/C13H20N4O2/c14-13(16-19)10-4-5-12(15-9-10)17-7-2-1-3-11(17)6-8-18/h4-5,9,11,18-19H,1-3,6-8H2,(H2,14,16)
InChIKeyWKDPLECYGPGYDM-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.92
Rot. Bonds4

About N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide

N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide (PubChem CID 24696730) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide
PubChem CID24696730
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide
SMILESN/C(=N\O)c1ccc(N2CCCCC2CCO)nc1
InChIInChI=1S/C13H20N4O2/c14-13(16-19)10-4-5-12(15-9-10)17-7-2-1-3-11(17)6-8-18/h4-5,9,11,18-19H,1-3,6-8H2,(H2,14,16)
InChIKeyWKDPLECYGPGYDM-UHFFFAOYSA-N
XLogP0.92
TPSA94.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.92
H-Bond Donors ≤ 53
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

N'-hydroxy-6-(2-methylpiperidin-1-yl)pyridine-3-carboximidamide
CID 24711133
6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-N'-hydroxypyridine-3-carboximidamide
CID 77065218
3-[1-(5-carbamoyl-2-pyridinyl)piperidin-2-yl]propanoic acid
CID 62217146
N'-hydroxy-6-pyrrolidin-1-ylpyridine-3-carboximidamide
CID 74313861
2-[1-[5-(ethylamino)-2-pyridinyl]piperidin-2-yl]ethanol
CID 82104328
6-[2-(hydroxymethyl)piperidin-1-yl]pyridine-3-carboximidamide
CID 61406687
N'-hydroxy-2-[2-(2-hydroxyethyl)piperidin-1-yl]benzenecarboximidamide
CID 43199962
N'-hydroxy-6-[3-(hydroxymethyl)piperidin-1-yl]pyridine-3-carboximidamide
CID 43590323
N'-hydroxy-2-[2-(2-hydroxyethyl)piperidin-1-yl]-6-methylpyrimidine-4-carboximidamide
CID 136906366
2-chloro-N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]benzenecarboximidamide
CID 76945268
[1-(5-tert-butyl-2-pyridinyl)piperidin-2-yl]methanol
CID 107875282
2-[1-(5,6-dimethylpyrazin-2-yl)piperidin-2-yl]ethanol
CID 114476751

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide?
The IUPAC name of N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide (CID 24696730) is N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide.
What is the SMILES notation for N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide?
The canonical SMILES for N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide is N/C(=N\O)c1ccc(N2CCCCC2CCO)nc1.
What is the InChIKey of N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide?
The InChIKey is WKDPLECYGPGYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c14-13(16-19)10-4-5-12(15-9-10)17-7-2-1-3-11(17)6-8-18/h4-5,9,11,18-19H,1-3,6-8H2,(H2,14,16).
What are the key properties of N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide?
N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide has a molecular weight of 264.33 g/mol, XLogP of 0.92, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-6-[2-(2-hydroxyethyl)piperidin-1-yl]pyridine-3-carboximidamide is sourced from PubChem (CID 24696730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).