N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide

C11H16N4O2 — CID 24693054

IUPACN'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide
SMILESCC1CN(c2ccc(/C(N)=N/O)cn2)CCO1
InChIInChI=1S/C11H16N4O2/c1-8-7-15(4-5-17-8)10-3-2-9(6-13-10)11(12)14-16/h2-3,6,8,16H,4-5,7H2,1H3,(H2,12,14)
InChIKeyPCZJEEGHVWUGKZ-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.40
Rot. Bonds2

About N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide

N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide (PubChem CID 24693054) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide
PubChem CID24693054
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC NameN'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide
SMILESCC1CN(c2ccc(/C(N)=N/O)cn2)CCO1
InChIInChI=1S/C11H16N4O2/c1-8-7-15(4-5-17-8)10-3-2-9(6-13-10)11(12)14-16/h2-3,6,8,16H,4-5,7H2,1H3,(H2,12,14)
InChIKeyPCZJEEGHVWUGKZ-UHFFFAOYSA-N
XLogP0.40
TPSA83.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.40
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

N'-hydroxy-6-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide
CID 76929782
6-[3-(dimethylamino)pyrrolidin-1-yl]-N'-hydroxypyridine-3-carboximidamide
CID 76986817
6-(2-methyl-1,4-oxazepan-4-yl)pyridine-3-carboximidamide
CID 62972140
N'-hydroxy-6-pyrrolidin-1-ylpyridine-3-carboximidamide
CID 74313861
2-methyl-1-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]guanidine
CID 110915666
N'-hydroxy-6-[3-(hydroxymethyl)piperidin-1-yl]pyridine-3-carboximidamide
CID 43590323
N'-hydroxy-6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carboximidamide
CID 43585296
N'-hydroxy-6-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]pyridine-3-carboximidamide
CID 81203418
N'-hydroxy-6-(2-methylpiperidin-1-yl)pyridine-3-carboximidamide
CID 24711133
6-(2-ethylmorpholin-4-yl)pyridine-3-carbothioamide
CID 43562927
6-[2-(hydroxymethyl)morpholin-4-yl]pyridine-3-carboxamide
CID 79839721
2-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-1-(2-methylpropyl)guanidine;hydroiodide
CID 111049273

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide?
The IUPAC name of N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide (CID 24693054) is N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide.
What is the SMILES notation for N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide?
The canonical SMILES for N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide is CC1CN(c2ccc(/C(N)=N/O)cn2)CCO1.
What is the InChIKey of N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide?
The InChIKey is PCZJEEGHVWUGKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-8-7-15(4-5-17-8)10-3-2-9(6-13-10)11(12)14-16/h2-3,6,8,16H,4-5,7H2,1H3,(H2,12,14).
What are the key properties of N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide?
N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide has a molecular weight of 236.27 g/mol, XLogP of 0.40, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-6-(2-methylmorpholin-4-yl)pyridine-3-carboximidamide is sourced from PubChem (CID 24693054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).