2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide

C16H20N4O — CID 63883747

IUPAC2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(N2CC(C)OC(C)C2)nc2ccccc12
InChIInChI=1S/C16H20N4O/c1-10-8-20(9-11(2)21-10)15-7-13(16(17)18)12-5-3-4-6-14(12)19-15/h3-7,10-11H,8-9H2,1-2H3,(H3,17,18)
InChIKeyRJXRHJQJYFJKMW-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.13
Rot. Bonds2

About 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide

2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide (PubChem CID 63883747) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide
PubChem CID63883747
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(N2CC(C)OC(C)C2)nc2ccccc12
InChIInChI=1S/C16H20N4O/c1-10-8-20(9-11(2)21-10)15-7-13(16(17)18)12-5-3-4-6-14(12)19-15/h3-7,10-11H,8-9H2,1-2H3,(H3,17,18)
InChIKeyRJXRHJQJYFJKMW-UHFFFAOYSA-N
XLogP2.13
TPSA75.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]quinoline-3-carboximidamide
CID 104958895
(2S,6S)-2,6-dimethyl-4-(4-methylquinolin-2-yl)morpholine
CID 705234
[2-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]methanamine
CID 62299635
2-(2,6-dimethylmorpholin-4-yl)benzenecarboximidamide
CID 43199936
2-(2,4-dimethylpiperidin-1-yl)quinoline-4-carboximidamide
CID 63884156
(2R,6S)-4-[4-(chloromethyl)quinolin-2-yl]-2,6-dimethylmorpholine
CID 104959969
1-[2-(2,6-dimethylmorpholin-4-yl)quinolin-4-yl]-N-methylmethanamine
CID 62285601
2-(3,5-dimethylpiperazin-1-yl)quinoline-4-carboxamide
CID 63884867
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methylpyridine-3-carboximidamide
CID 104958903
2-(4-bromo-3,5-dimethylpyrazol-1-yl)quinoline-4-carboximidamide
CID 63884159
2-(3,4-dihydroxypyrrolidin-1-yl)-N'-hydroxyquinoline-4-carboximidamide
CID 136766529
2-bromo-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]benzenecarboximidamide
CID 107279407

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide (CID 63883747) is 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide is [H]/N=C(\N)c1cc(N2CC(C)OC(C)C2)nc2ccccc12.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide?
The InChIKey is RJXRHJQJYFJKMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-10-8-20(9-11(2)21-10)15-7-13(16(17)18)12-5-3-4-6-14(12)19-15/h3-7,10-11H,8-9H2,1-2H3,(H3,17,18).
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide?
2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide has a molecular weight of 284.36 g/mol, XLogP of 2.13, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)quinoline-4-carboximidamide is sourced from PubChem (CID 63883747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).