6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide

C11H16N4 — CID 60974035

IUPAC6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCCC2C)nc1
InChIInChI=1S/C11H16N4/c1-8-3-2-6-15(8)10-5-4-9(7-14-10)11(12)13/h4-5,7-8H,2-3,6H2,1H3,(H3,12,13)
InChIKeyWYRHRZOQEHELHW-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.35
Rot. Bonds2

About 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide

6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide (PubChem CID 60974035) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide.

Molecular Properties

Compound Name6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide
PubChem CID60974035
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCCC2C)nc1
InChIInChI=1S/C11H16N4/c1-8-3-2-6-15(8)10-5-4-9(7-14-10)11(12)13/h4-5,7-8H,2-3,6H2,1H3,(H3,12,13)
InChIKeyWYRHRZOQEHELHW-UHFFFAOYSA-N
XLogP1.35
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide?
The IUPAC name of 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide (CID 60974035) is 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide.
What is the SMILES notation for 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide?
The canonical SMILES for 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(N2CCCC2C)nc1.
What is the InChIKey of 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide?
The InChIKey is WYRHRZOQEHELHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-8-3-2-6-15(8)10-5-4-9(7-14-10)11(12)13/h4-5,7-8H,2-3,6H2,1H3,(H3,12,13).
What are the key properties of 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide?
6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide has a molecular weight of 204.28 g/mol, XLogP of 1.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylpyrrolidin-1-yl)pyridine-3-carboximidamide is sourced from PubChem (CID 60974035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).