sodium;N,N'-dicyclohexylmethanediimine;hydride

C13H23N2Na — CID 175020266

IUPACsodium;N,N'-dicyclohexylmethanediimine;hydride
SMILESC(=NC1CCCCC1)=NC1CCCCC1.[H-].[Na+]
InChIInChI=1S/C13H22N2.Na.H/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;;/h12-13H,1-10H2;;/q;+1;-1
InChIKeyVFTGFGQBIBXDPR-UHFFFAOYSA-N
MW230.33 g/mol
LogP0.94
Rot. Bonds2

About sodium;N,N'-dicyclohexylmethanediimine;hydride

sodium;N,N'-dicyclohexylmethanediimine;hydride (PubChem CID 175020266) has the molecular formula C13H23N2Na and a molecular weight of 230.33 g/mol. Its IUPAC name is sodium;N,N'-dicyclohexylmethanediimine;hydride.

Molecular Properties

Compound Namesodium;N,N'-dicyclohexylmethanediimine;hydride
PubChem CID175020266
Molecular FormulaC13H23N2Na
Molecular Weight230.33 g/mol
Exact Mass230.18
IUPAC Namesodium;N,N'-dicyclohexylmethanediimine;hydride
SMILESC(=NC1CCCCC1)=NC1CCCCC1.[H-].[Na+]
InChIInChI=1S/C13H22N2.Na.H/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;;/h12-13H,1-10H2;;/q;+1;-1
InChIKeyVFTGFGQBIBXDPR-UHFFFAOYSA-N
XLogP0.94
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N'-dicyclohexylmethanediimine;λ2-plumbane
CID 174956509
N,N'-dicyclohexylmethanediimine;isocyanic acid
CID 87197010
lithium;N,N'-dicyclohexylmethanediimine;thiocyanate
CID 87293630
N,N'-dicyclohexylmethanediimine;propan-2-one
CID 142827484
N'-cyclohexyl-N-[4-(cyclohexyliminomethylideneamino)butyl]methanediimine
CID 131972397
N-cyclohexyl-N'-[1-(cyclohexyliminomethylideneamino)ethyl]methanediimine
CID 141213199
N-cyclohexyl-N'-[4-(cyclohexyliminomethylideneamino)phenyl]methanediimine
CID 87328488
N-cyclohexylethenimine
CID 22149410
N'-cycloundecylmethanediimine
CID 166908646
N,N'-dicyclohexylmethanediimine;4-methylmorpholine
CID 174388370
N,N'-dicyclohexylmethanediimine;ethynoxyethane
CID 21481424
N'-tert-butyl-N-cyclopentylmethanediimine
CID 44613172

Frequently Asked Questions

What is the IUPAC name of sodium;N,N'-dicyclohexylmethanediimine;hydride?
The IUPAC name of sodium;N,N'-dicyclohexylmethanediimine;hydride (CID 175020266) is sodium;N,N'-dicyclohexylmethanediimine;hydride.
What is the SMILES notation for sodium;N,N'-dicyclohexylmethanediimine;hydride?
The canonical SMILES for sodium;N,N'-dicyclohexylmethanediimine;hydride is C(=NC1CCCCC1)=NC1CCCCC1.[H-].[Na+].
What is the InChIKey of sodium;N,N'-dicyclohexylmethanediimine;hydride?
The InChIKey is VFTGFGQBIBXDPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2.Na.H/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;;/h12-13H,1-10H2;;/q;+1;-1.
What are the key properties of sodium;N,N'-dicyclohexylmethanediimine;hydride?
sodium;N,N'-dicyclohexylmethanediimine;hydride has a molecular weight of 230.33 g/mol, XLogP of 0.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;N,N'-dicyclohexylmethanediimine;hydride is sourced from PubChem (CID 175020266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).