3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide

C15H24N4 — CID 111802470

IUPAC3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide
SMILESCc1ccc(CC/N=C(\N)N2CCCC(C)C2)cn1
InChIInChI=1S/C15H24N4/c1-12-4-3-9-19(11-12)15(16)17-8-7-14-6-5-13(2)18-10-14/h5-6,10,12H,3-4,7-9,11H2,1-2H3,(H2,16,17)
InChIKeyFLNJIEXVQADUJC-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.98
Rot. Bonds3

About 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide

3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide (PubChem CID 111802470) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide.

Molecular Properties

Compound Name3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide
PubChem CID111802470
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide
SMILESCc1ccc(CC/N=C(\N)N2CCCC(C)C2)cn1
InChIInChI=1S/C15H24N4/c1-12-4-3-9-19(11-12)15(16)17-8-7-14-6-5-13(2)18-10-14/h5-6,10,12H,3-4,7-9,11H2,1-2H3,(H2,16,17)
InChIKeyFLNJIEXVQADUJC-UHFFFAOYSA-N
XLogP1.98
TPSA54.51 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

N'-[2-(6-methyl-3-pyridinyl)ethyl]azepane-1-carboximidamide
CID 75513059
3-methyl-N'-(2-phenylethyl)piperidine-1-carboximidamide
CID 111022901
N'-[2-(3,5-dimethylphenyl)ethyl]-3-methylpiperidine-1-carboximidamide
CID 111818646
N'-[[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]methyl]-3-methylpiperidine-1-carboximidamide;hydroiodide
CID 111053246
3-methyl-N'-(pyridin-3-ylmethyl)piperidine-1-carboximidamide
CID 111023364
3-methyl-N'-[2-(4-methylpyrazol-1-yl)ethyl]piperidine-1-carboximidamide
CID 111806202
N'-[2-(1-benzylimidazol-2-yl)ethyl]-3-methylpiperidine-1-carboximidamide;hydroiodide
CID 111042145
N'-[[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]-3-methylpiperidine-1-carboximidamide
CID 111053335
3-[2-[[amino-(3-methylpiperidin-1-yl)methylidene]amino]ethyl]-N-methylbenzamide
CID 111817572
N'-(3-hydroxy-2-methylpropyl)-3-methylpiperidine-1-carboximidamide
CID 111076526
3-methyl-N'-(3-phenoxypropyl)piperidine-1-carboximidamide
CID 111036940
(3R)-3-methyl-N'-(2-methylsulfanylethyl)piperidine-1-carboximidamide
CID 100673266

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide?
The IUPAC name of 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide (CID 111802470) is 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide.
What is the SMILES notation for 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide?
The canonical SMILES for 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide is Cc1ccc(CC/N=C(\N)N2CCCC(C)C2)cn1.
What is the InChIKey of 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide?
The InChIKey is FLNJIEXVQADUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-12-4-3-9-19(11-12)15(16)17-8-7-14-6-5-13(2)18-10-14/h5-6,10,12H,3-4,7-9,11H2,1-2H3,(H2,16,17).
What are the key properties of 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide?
3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide has a molecular weight of 260.38 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N'-[2-(6-methyl-3-pyridinyl)ethyl]piperidine-1-carboximidamide is sourced from PubChem (CID 111802470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).