N,N'-dicyclohexylpiperidine-1-carboximidamide

C18H33N3 — CID 10379543

IUPACN,N'-dicyclohexylpiperidine-1-carboximidamide
SMILESC1CCC(/N=C(/NC2CCCCC2)N2CCCCC2)CC1
InChIInChI=1S/C18H33N3/c1-4-10-16(11-5-1)19-18(21-14-8-3-9-15-21)20-17-12-6-2-7-13-17/h16-17H,1-15H2,(H,19,20)
InChIKeyPGYKBNKNVQGRIC-UHFFFAOYSA-N
MW291.48 g/mol
LogP4.08
Rot. Bonds2

About N,N'-dicyclohexylpiperidine-1-carboximidamide

N,N'-dicyclohexylpiperidine-1-carboximidamide (PubChem CID 10379543) has the molecular formula C18H33N3 and a molecular weight of 291.48 g/mol. Its IUPAC name is N,N'-dicyclohexylpiperidine-1-carboximidamide.

Molecular Properties

Compound NameN,N'-dicyclohexylpiperidine-1-carboximidamide
PubChem CID10379543
Molecular FormulaC18H33N3
Molecular Weight291.48 g/mol
Exact Mass291.27
IUPAC NameN,N'-dicyclohexylpiperidine-1-carboximidamide
SMILESC1CCC(/N=C(/NC2CCCCC2)N2CCCCC2)CC1
InChIInChI=1S/C18H33N3/c1-4-10-16(11-5-1)19-18(21-14-8-3-9-15-21)20-17-12-6-2-7-13-17/h16-17H,1-15H2,(H,19,20)
InChIKeyPGYKBNKNVQGRIC-UHFFFAOYSA-N
XLogP4.08
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.48
LogP ≤ 54.08
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,N'-dicyclohexylpiperidine-1-carboximidamide?
The IUPAC name of N,N'-dicyclohexylpiperidine-1-carboximidamide (CID 10379543) is N,N'-dicyclohexylpiperidine-1-carboximidamide.
What is the SMILES notation for N,N'-dicyclohexylpiperidine-1-carboximidamide?
The canonical SMILES for N,N'-dicyclohexylpiperidine-1-carboximidamide is C1CCC(/N=C(/NC2CCCCC2)N2CCCCC2)CC1.
What is the InChIKey of N,N'-dicyclohexylpiperidine-1-carboximidamide?
The InChIKey is PGYKBNKNVQGRIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3/c1-4-10-16(11-5-1)19-18(21-14-8-3-9-15-21)20-17-12-6-2-7-13-17/h16-17H,1-15H2,(H,19,20).
What are the key properties of N,N'-dicyclohexylpiperidine-1-carboximidamide?
N,N'-dicyclohexylpiperidine-1-carboximidamide has a molecular weight of 291.48 g/mol, XLogP of 4.08, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dicyclohexylpiperidine-1-carboximidamide is sourced from PubChem (CID 10379543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).