N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide

C16H31N3 — CID 55158726

IUPACN'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide
SMILESCCC1(CC)CCN(/C(N)=N/C2CCCCC2)CC1
InChIInChI=1S/C16H31N3/c1-3-16(4-2)10-12-19(13-11-16)15(17)18-14-8-6-5-7-9-14/h14H,3-13H2,1-2H3,(H2,17,18)
InChIKeyQIEQNHZEMMEFBM-UHFFFAOYSA-N
MW265.44 g/mol
LogP3.54
Rot. Bonds3

About N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide

N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide (PubChem CID 55158726) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide
PubChem CID55158726
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC NameN'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide
SMILESCCC1(CC)CCN(/C(N)=N/C2CCCCC2)CC1
InChIInChI=1S/C16H31N3/c1-3-16(4-2)10-12-19(13-11-16)15(17)18-14-8-6-5-7-9-14/h14H,3-13H2,1-2H3,(H2,17,18)
InChIKeyQIEQNHZEMMEFBM-UHFFFAOYSA-N
XLogP3.54
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide?
The IUPAC name of N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide (CID 55158726) is N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide.
What is the SMILES notation for N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide?
The canonical SMILES for N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide is CCC1(CC)CCN(/C(N)=N/C2CCCCC2)CC1.
What is the InChIKey of N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide?
The InChIKey is QIEQNHZEMMEFBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-3-16(4-2)10-12-19(13-11-16)15(17)18-14-8-6-5-7-9-14/h14H,3-13H2,1-2H3,(H2,17,18).
What are the key properties of N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide?
N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide has a molecular weight of 265.44 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-4,4-diethylpiperidine-1-carboximidamide is sourced from PubChem (CID 55158726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).