4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide

C13H20N4 — CID 55156286

IUPAC4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cc(N2CCCC(C)C2C)ccn1
InChIInChI=1S/C13H20N4/c1-9-4-3-7-17(10(9)2)11-5-6-16-12(8-11)13(14)15/h5-6,8-10H,3-4,7H2,1-2H3,(H3,14,15)
InChIKeyPXMVXXYZGBQGJJ-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.99
Rot. Bonds2

About 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide

4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide (PubChem CID 55156286) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide.

Molecular Properties

Compound Name4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide
PubChem CID55156286
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC Name4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cc(N2CCCC(C)C2C)ccn1
InChIInChI=1S/C13H20N4/c1-9-4-3-7-17(10(9)2)11-5-6-16-12(8-11)13(14)15/h5-6,8-10H,3-4,7H2,1-2H3,(H3,14,15)
InChIKeyPXMVXXYZGBQGJJ-UHFFFAOYSA-N
XLogP1.99
TPSA66.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.99
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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Related Compounds

4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)pyridine-2-carboximidamide
CID 62926493
4-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]pyridine-2-carboximidamide
CID 102781467
4-(3-methylpiperidin-1-yl)pyridine-2-carboximidamide
CID 62924914
4-[2-(hydroxymethyl)piperidin-1-yl]pyridine-2-carboximidamide
CID 62924925
4-[2-(3-hydroxypropyl)pyrrolidin-1-yl]pyridine-2-carboximidamide
CID 62925971
4-(3,4-dimethylpyrrolidin-1-yl)pyridine-2-carboximidamide
CID 79188815
4-(3-methoxy-4-methylpiperidin-1-yl)pyridine-2-carboximidamide
CID 102958415
4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carbonitrile
CID 62936415
4-(3-hydroxy-3-methylpyrrolidin-1-yl)pyridine-2-carboximidamide
CID 103356330
4-(3,4,5-trimethylpiperazin-1-yl)pyridine-2-carboximidamide
CID 114538182
4-(2-methylcyclohexyl)oxypyridine-2-carboximidamide
CID 62924444
4-(2,3-dimethylpiperidin-1-yl)-3-methylbenzenecarboximidamide
CID 62123919

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide?
The IUPAC name of 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide (CID 55156286) is 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide.
What is the SMILES notation for 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide?
The canonical SMILES for 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide is [H]/N=C(\N)c1cc(N2CCCC(C)C2C)ccn1.
What is the InChIKey of 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide?
The InChIKey is PXMVXXYZGBQGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-9-4-3-7-17(10(9)2)11-5-6-16-12(8-11)13(14)15/h5-6,8-10H,3-4,7H2,1-2H3,(H3,14,15).
What are the key properties of 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide?
4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide has a molecular weight of 232.33 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylpiperidin-1-yl)pyridine-2-carboximidamide is sourced from PubChem (CID 55156286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).