N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide

C19H35N3 — CID 142448718

IUPACN-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide
SMILESCC1CCCCC1/N=C(\NC1CCCCC1)N1CCCCC1
InChIInChI=1S/C19H35N3/c1-16-10-6-7-13-18(16)21-19(22-14-8-3-9-15-22)20-17-11-4-2-5-12-17/h16-18H,2-15H2,1H3,(H,20,21)
InChIKeyUOFHHGRSAUTCAB-UHFFFAOYSA-N
MW305.51 g/mol
LogP4.33
Rot. Bonds2

About N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide

N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide (PubChem CID 142448718) has the molecular formula C19H35N3 and a molecular weight of 305.51 g/mol. Its IUPAC name is N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide.

Molecular Properties

Compound NameN-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide
PubChem CID142448718
Molecular FormulaC19H35N3
Molecular Weight305.51 g/mol
Exact Mass305.28
IUPAC NameN-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide
SMILESCC1CCCCC1/N=C(\NC1CCCCC1)N1CCCCC1
InChIInChI=1S/C19H35N3/c1-16-10-6-7-13-18(16)21-19(22-14-8-3-9-15-22)20-17-11-4-2-5-12-17/h16-18H,2-15H2,1H3,(H,20,21)
InChIKeyUOFHHGRSAUTCAB-UHFFFAOYSA-N
XLogP4.33
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.51
LogP ≤ 54.33
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-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide?
The IUPAC name of N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide (CID 142448718) is N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide.
What is the SMILES notation for N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide?
The canonical SMILES for N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide is CC1CCCCC1/N=C(\NC1CCCCC1)N1CCCCC1.
What is the InChIKey of N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide?
The InChIKey is UOFHHGRSAUTCAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35N3/c1-16-10-6-7-13-18(16)21-19(22-14-8-3-9-15-22)20-17-11-4-2-5-12-17/h16-18H,2-15H2,1H3,(H,20,21).
What are the key properties of N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide?
N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide has a molecular weight of 305.51 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N'-(2-methylcyclohexyl)piperidine-1-carboximidamide is sourced from PubChem (CID 142448718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).