2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide

C12H18N4 — CID 114768904

IUPAC2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N2CCCC2C)c1
InChIInChI=1S/C12H18N4/c1-8-6-10(12(13)14)7-11(15-8)16-5-3-4-9(16)2/h6-7,9H,3-5H2,1-2H3,(H3,13,14)
InChIKeyLZBGNWSRLOBFTQ-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.66
Rot. Bonds2

About 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide

2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide (PubChem CID 114768904) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide.

Molecular Properties

Compound Name2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide
PubChem CID114768904
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1cc(C)nc(N2CCCC2C)c1
InChIInChI=1S/C12H18N4/c1-8-6-10(12(13)14)7-11(15-8)16-5-3-4-9(16)2/h6-7,9H,3-5H2,1-2H3,(H3,13,14)
InChIKeyLZBGNWSRLOBFTQ-UHFFFAOYSA-N
XLogP1.66
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.66
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 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide?
The IUPAC name of 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide (CID 114768904) is 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide.
What is the SMILES notation for 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide?
The canonical SMILES for 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide is [H]/N=C(\N)c1cc(C)nc(N2CCCC2C)c1.
What is the InChIKey of 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide?
The InChIKey is LZBGNWSRLOBFTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-8-6-10(12(13)14)7-11(15-8)16-5-3-4-9(16)2/h6-7,9H,3-5H2,1-2H3,(H3,13,14).
What are the key properties of 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide?
2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide has a molecular weight of 218.30 g/mol, XLogP of 1.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-methylpyrrolidin-1-yl)pyridine-4-carboximidamide is sourced from PubChem (CID 114768904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).