1-(2,2-dimethylpropyl)piperidine-4-carboximidamide

C11H23N3 — CID 163564400

IUPAC1-(2,2-dimethylpropyl)piperidine-4-carboximidamide
SMILES[H]/N=C(\N)C1CCN(CC(C)(C)C)CC1
InChIInChI=1S/C11H23N3/c1-11(2,3)8-14-6-4-9(5-7-14)10(12)13/h9H,4-8H2,1-3H3,(H3,12,13)
InChIKeyWBIRKZDXGFONCG-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.68
Rot. Bonds2

About 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide

1-(2,2-dimethylpropyl)piperidine-4-carboximidamide (PubChem CID 163564400) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide.

Molecular Properties

Compound Name1-(2,2-dimethylpropyl)piperidine-4-carboximidamide
PubChem CID163564400
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name1-(2,2-dimethylpropyl)piperidine-4-carboximidamide
SMILES[H]/N=C(\N)C1CCN(CC(C)(C)C)CC1
InChIInChI=1S/C11H23N3/c1-11(2,3)8-14-6-4-9(5-7-14)10(12)13/h9H,4-8H2,1-3H3,(H3,12,13)
InChIKeyWBIRKZDXGFONCG-UHFFFAOYSA-N
XLogP1.68
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.68
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide?
The IUPAC name of 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide (CID 163564400) is 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide.
What is the SMILES notation for 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide?
The canonical SMILES for 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide is [H]/N=C(\N)C1CCN(CC(C)(C)C)CC1.
What is the InChIKey of 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide?
The InChIKey is WBIRKZDXGFONCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-11(2,3)8-14-6-4-9(5-7-14)10(12)13/h9H,4-8H2,1-3H3,(H3,12,13).
What are the key properties of 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide?
1-(2,2-dimethylpropyl)piperidine-4-carboximidamide has a molecular weight of 197.33 g/mol, XLogP of 1.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropyl)piperidine-4-carboximidamide is sourced from PubChem (CID 163564400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).