N,N'-dicyclohexylmethanediimine;methanedithione

C14H22N2S2 — CID 88597634

IUPACN,N'-dicyclohexylmethanediimine;methanedithione
SMILESC(=NC1CCCCC1)=NC1CCCCC1.S=C=S
InChIInChI=1S/C13H22N2.CS2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;2-1-3/h12-13H,1-10H2;
InChIKeyNFKBNWKLPISZLY-UHFFFAOYSA-N
MW282.48 g/mol
LogP4.84
Rot. Bonds2

About N,N'-dicyclohexylmethanediimine;methanedithione

N,N'-dicyclohexylmethanediimine;methanedithione (PubChem CID 88597634) has the molecular formula C14H22N2S2 and a molecular weight of 282.48 g/mol. Its IUPAC name is N,N'-dicyclohexylmethanediimine;methanedithione.

Molecular Properties

Compound NameN,N'-dicyclohexylmethanediimine;methanedithione
PubChem CID88597634
Molecular FormulaC14H22N2S2
Molecular Weight282.48 g/mol
Exact Mass282.12
IUPAC NameN,N'-dicyclohexylmethanediimine;methanedithione
SMILESC(=NC1CCCCC1)=NC1CCCCC1.S=C=S
InChIInChI=1S/C13H22N2.CS2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;2-1-3/h12-13H,1-10H2;
InChIKeyNFKBNWKLPISZLY-UHFFFAOYSA-N
XLogP4.84
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.48
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N'-dicyclohexylmethanediimine;methanedithione?
The IUPAC name of N,N'-dicyclohexylmethanediimine;methanedithione (CID 88597634) is N,N'-dicyclohexylmethanediimine;methanedithione.
What is the SMILES notation for N,N'-dicyclohexylmethanediimine;methanedithione?
The canonical SMILES for N,N'-dicyclohexylmethanediimine;methanedithione is C(=NC1CCCCC1)=NC1CCCCC1.S=C=S.
What is the InChIKey of N,N'-dicyclohexylmethanediimine;methanedithione?
The InChIKey is NFKBNWKLPISZLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2.CS2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;2-1-3/h12-13H,1-10H2;.
What are the key properties of N,N'-dicyclohexylmethanediimine;methanedithione?
N,N'-dicyclohexylmethanediimine;methanedithione has a molecular weight of 282.48 g/mol, XLogP of 4.84, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dicyclohexylmethanediimine;methanedithione is sourced from PubChem (CID 88597634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).