N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide

C18H33N3O — CID 14423480

IUPACN,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide
SMILESCN(/C(=N/C1CCCCC1)N1CCOCC1)C1CCCCC1
InChIInChI=1S/C18H33N3O/c1-20(17-10-6-3-7-11-17)18(21-12-14-22-15-13-21)19-16-8-4-2-5-9-16/h16-17H,2-15H2,1H3/b19-18-
InChIKeySACSGEUNQRZQSG-HNENSFHCSA-N
MW307.48 g/mol
LogP3.27
Rot. Bonds2

About N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide

N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide (PubChem CID 14423480) has the molecular formula C18H33N3O and a molecular weight of 307.48 g/mol. Its IUPAC name is N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide.

Molecular Properties

Compound NameN,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide
PubChem CID14423480
Molecular FormulaC18H33N3O
Molecular Weight307.48 g/mol
Exact Mass307.26
IUPAC NameN,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide
SMILESCN(/C(=N/C1CCCCC1)N1CCOCC1)C1CCCCC1
InChIInChI=1S/C18H33N3O/c1-20(17-10-6-3-7-11-17)18(21-12-14-22-15-13-21)19-16-8-4-2-5-9-16/h16-17H,2-15H2,1H3/b19-18-
InChIKeySACSGEUNQRZQSG-HNENSFHCSA-N
XLogP3.27
TPSA28.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.48
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide?
The IUPAC name of N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide (CID 14423480) is N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide.
What is the SMILES notation for N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide?
The canonical SMILES for N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide is CN(/C(=N/C1CCCCC1)N1CCOCC1)C1CCCCC1.
What is the InChIKey of N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide?
The InChIKey is SACSGEUNQRZQSG-HNENSFHCSA-N. The full InChI is InChI=1S/C18H33N3O/c1-20(17-10-6-3-7-11-17)18(21-12-14-22-15-13-21)19-16-8-4-2-5-9-16/h16-17H,2-15H2,1H3/b19-18-.
What are the key properties of N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide?
N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide has a molecular weight of 307.48 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dicyclohexyl-N-methylmorpholine-4-carboximidamide is sourced from PubChem (CID 14423480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).