6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide

C14H21N5O — CID 63170283

IUPAC6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCC(N3CCOCC3)C2)nc1
InChIInChI=1S/C14H21N5O/c15-14(16)11-1-2-13(17-9-11)19-4-3-12(10-19)18-5-7-20-8-6-18/h1-2,9,12H,3-8,10H2,(H3,15,16)
InChIKeyCWGGVGPUOMSKHU-UHFFFAOYSA-N
MW275.36 g/mol
LogP0.28
Rot. Bonds3

About 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide

6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide (PubChem CID 63170283) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide.

Molecular Properties

Compound Name6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide
PubChem CID63170283
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCC(N3CCOCC3)C2)nc1
InChIInChI=1S/C14H21N5O/c15-14(16)11-1-2-13(17-9-11)19-4-3-12(10-19)18-5-7-20-8-6-18/h1-2,9,12H,3-8,10H2,(H3,15,16)
InChIKeyCWGGVGPUOMSKHU-UHFFFAOYSA-N
XLogP0.28
TPSA78.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.28
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'}

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Frequently Asked Questions

What is the IUPAC name of 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide?
The IUPAC name of 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide (CID 63170283) is 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide.
What is the SMILES notation for 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide?
The canonical SMILES for 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(N2CCC(N3CCOCC3)C2)nc1.
What is the InChIKey of 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide?
The InChIKey is CWGGVGPUOMSKHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c15-14(16)11-1-2-13(17-9-11)19-4-3-12(10-19)18-5-7-20-8-6-18/h1-2,9,12H,3-8,10H2,(H3,15,16).
What are the key properties of 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide?
6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide has a molecular weight of 275.36 g/mol, XLogP of 0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carboximidamide is sourced from PubChem (CID 63170283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).