N,N'-dicyclohexylmethanediimine;4-methylmorpholine

C18H33N3O — CID 174388370

IUPACN,N'-dicyclohexylmethanediimine;4-methylmorpholine
SMILESC(=NC1CCCCC1)=NC1CCCCC1.CN1CCOCC1
InChIInChI=1S/C13H22N2.C5H11NO/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;1-6-2-4-7-5-3-6/h12-13H,1-10H2;2-5H2,1H3
InChIKeyZKJQZMNHKRHOHD-UHFFFAOYSA-N
MW307.48 g/mol
LogP3.77
Rot. Bonds2

About N,N'-dicyclohexylmethanediimine;4-methylmorpholine

N,N'-dicyclohexylmethanediimine;4-methylmorpholine (PubChem CID 174388370) has the molecular formula C18H33N3O and a molecular weight of 307.48 g/mol. Its IUPAC name is N,N'-dicyclohexylmethanediimine;4-methylmorpholine.

Molecular Properties

Compound NameN,N'-dicyclohexylmethanediimine;4-methylmorpholine
PubChem CID174388370
Molecular FormulaC18H33N3O
Molecular Weight307.48 g/mol
Exact Mass307.26
IUPAC NameN,N'-dicyclohexylmethanediimine;4-methylmorpholine
SMILESC(=NC1CCCCC1)=NC1CCCCC1.CN1CCOCC1
InChIInChI=1S/C13H22N2.C5H11NO/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;1-6-2-4-7-5-3-6/h12-13H,1-10H2;2-5H2,1H3
InChIKeyZKJQZMNHKRHOHD-UHFFFAOYSA-N
XLogP3.77
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.48
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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
sodium;N,N'-dicyclohexylmethanediimine;hydride
CID 175020266
N,N'-dicyclohexylmethanediimine;propan-2-one
CID 142827484
19-methyl-1,4,7,10,13,16-hexaoxa-19-azacyclohenicosane
CID 6612303
ethane;4-methylmorpholine
CID 54432133
4-fluoro-1-methylpiperidine;4-methylmorpholine
CID 153371912
cyclohexyl-(cyclohexyliminomethylidene)-morpholin-4-ylazanium
CID 19994458
lithium;4-methylmorpholine;chloride
CID 172748649
1,4-dimethylpiperazine;methanamine;4-methylmorpholine;1-methylpiperidine;1-methylpyrrolidine
CID 158044460
7-methyl-1,4,7-dioxazecane
CID 59020799
6-methyl-1-oxa-6-azacycloundecane
CID 123668114
butane;bis(4-methylmorpholine)
CID 159010392

Frequently Asked Questions

What is the IUPAC name of N,N'-dicyclohexylmethanediimine;4-methylmorpholine?
The IUPAC name of N,N'-dicyclohexylmethanediimine;4-methylmorpholine (CID 174388370) is N,N'-dicyclohexylmethanediimine;4-methylmorpholine.
What is the SMILES notation for N,N'-dicyclohexylmethanediimine;4-methylmorpholine?
The canonical SMILES for N,N'-dicyclohexylmethanediimine;4-methylmorpholine is C(=NC1CCCCC1)=NC1CCCCC1.CN1CCOCC1.
What is the InChIKey of N,N'-dicyclohexylmethanediimine;4-methylmorpholine?
The InChIKey is ZKJQZMNHKRHOHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2.C5H11NO/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13;1-6-2-4-7-5-3-6/h12-13H,1-10H2;2-5H2,1H3.
What are the key properties of N,N'-dicyclohexylmethanediimine;4-methylmorpholine?
N,N'-dicyclohexylmethanediimine;4-methylmorpholine has a molecular weight of 307.48 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dicyclohexylmethanediimine;4-methylmorpholine is sourced from PubChem (CID 174388370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).