N,N'-dicyclohexylpiperazine-1-carboximidamide

C17H32N4 — CID 12558941

IUPACN,N'-dicyclohexylpiperazine-1-carboximidamide
SMILESC1CCC(/N=C(/NC2CCCCC2)N2CCNCC2)CC1
InChIInChI=1S/C17H32N4/c1-3-7-15(8-4-1)19-17(21-13-11-18-12-14-21)20-16-9-5-2-6-10-16/h15-16,18H,1-14H2,(H,19,20)
InChIKeyIMVQBYDZDJRFGB-UHFFFAOYSA-N
MW292.47 g/mol
LogP2.50
Rot. Bonds2

About N,N'-dicyclohexylpiperazine-1-carboximidamide

N,N'-dicyclohexylpiperazine-1-carboximidamide (PubChem CID 12558941) has the molecular formula C17H32N4 and a molecular weight of 292.47 g/mol. Its IUPAC name is N,N'-dicyclohexylpiperazine-1-carboximidamide.

Molecular Properties

Compound NameN,N'-dicyclohexylpiperazine-1-carboximidamide
PubChem CID12558941
Molecular FormulaC17H32N4
Molecular Weight292.47 g/mol
Exact Mass292.26
IUPAC NameN,N'-dicyclohexylpiperazine-1-carboximidamide
SMILESC1CCC(/N=C(/NC2CCCCC2)N2CCNCC2)CC1
InChIInChI=1S/C17H32N4/c1-3-7-15(8-4-1)19-17(21-13-11-18-12-14-21)20-16-9-5-2-6-10-16/h15-16,18H,1-14H2,(H,19,20)
InChIKeyIMVQBYDZDJRFGB-UHFFFAOYSA-N
XLogP2.50
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 52.50
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 N,N'-dicyclohexylpiperazine-1-carboximidamide?
The IUPAC name of N,N'-dicyclohexylpiperazine-1-carboximidamide (CID 12558941) is N,N'-dicyclohexylpiperazine-1-carboximidamide.
What is the SMILES notation for N,N'-dicyclohexylpiperazine-1-carboximidamide?
The canonical SMILES for N,N'-dicyclohexylpiperazine-1-carboximidamide is C1CCC(/N=C(/NC2CCCCC2)N2CCNCC2)CC1.
What is the InChIKey of N,N'-dicyclohexylpiperazine-1-carboximidamide?
The InChIKey is IMVQBYDZDJRFGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4/c1-3-7-15(8-4-1)19-17(21-13-11-18-12-14-21)20-16-9-5-2-6-10-16/h15-16,18H,1-14H2,(H,19,20).
What are the key properties of N,N'-dicyclohexylpiperazine-1-carboximidamide?
N,N'-dicyclohexylpiperazine-1-carboximidamide has a molecular weight of 292.47 g/mol, XLogP of 2.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dicyclohexylpiperazine-1-carboximidamide is sourced from PubChem (CID 12558941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).