N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide

C15H24N4O2 — CID 81038142

IUPACN'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide
SMILESCc1cc(N2CC(C)OC(C)(C)C2)c(/C(N)=N/O)c(C)n1
InChIInChI=1S/C15H24N4O2/c1-9-6-12(13(11(3)17-9)14(16)18-20)19-7-10(2)21-15(4,5)8-19/h6,10,20H,7-8H2,1-5H3,(H2,16,18)
InChIKeyTUJYCYYQPPEJKF-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.80
Rot. Bonds2

About N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide

N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide (PubChem CID 81038142) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide
PubChem CID81038142
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide
SMILESCc1cc(N2CC(C)OC(C)(C)C2)c(/C(N)=N/O)c(C)n1
InChIInChI=1S/C15H24N4O2/c1-9-6-12(13(11(3)17-9)14(16)18-20)19-7-10(2)21-15(4,5)8-19/h6,10,20H,7-8H2,1-5H3,(H2,16,18)
InChIKeyTUJYCYYQPPEJKF-UHFFFAOYSA-N
XLogP1.80
TPSA83.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.80
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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Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide?
The IUPAC name of N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide (CID 81038142) is N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide.
What is the SMILES notation for N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide?
The canonical SMILES for N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide is Cc1cc(N2CC(C)OC(C)(C)C2)c(/C(N)=N/O)c(C)n1.
What is the InChIKey of N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide?
The InChIKey is TUJYCYYQPPEJKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-9-6-12(13(11(3)17-9)14(16)18-20)19-7-10(2)21-15(4,5)8-19/h6,10,20H,7-8H2,1-5H3,(H2,16,18).
What are the key properties of N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide?
N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide has a molecular weight of 292.38 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2,6-dimethyl-4-(2,2,6-trimethylmorpholin-4-yl)pyridine-3-carboximidamide is sourced from PubChem (CID 81038142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).