2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine

C14H28N4O — CID 62367901

IUPAC2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine
SMILESCC(CN1CCOCC1)N/C(N)=N/C1CCCCC1
InChIInChI=1S/C14H28N4O/c1-12(11-18-7-9-19-10-8-18)16-14(15)17-13-5-3-2-4-6-13/h12-13H,2-11H2,1H3,(H3,15,16,17)
InChIKeyUKHVMOZTZODSRL-UHFFFAOYSA-N
MW268.40 g/mol
LogP0.94
Rot. Bonds4

About 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine

2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine (PubChem CID 62367901) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine.

Molecular Properties

Compound Name2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine
PubChem CID62367901
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC Name2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine
SMILESCC(CN1CCOCC1)N/C(N)=N/C1CCCCC1
InChIInChI=1S/C14H28N4O/c1-12(11-18-7-9-19-10-8-18)16-14(15)17-13-5-3-2-4-6-13/h12-13H,2-11H2,1H3,(H3,15,16,17)
InChIKeyUKHVMOZTZODSRL-UHFFFAOYSA-N
XLogP0.94
TPSA62.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N'-dicyclohexyl-4-morpholinecarboxamidine
CID 21079
N-cyclohexyl-N'-cyclopentylmorpholine-4-carboximidamide
CID 10333852
N-cyclohexyl-N'-methylmorpholine-4-carboximidamide
CID 172436430
1-Ethyl-2-(2-morpholin-4-ylpropyl)-3-(5,5,5-trifluoropentyl)guanidine;hydroiodide
CID 112431208
1-Ethyl-2-(2-morpholin-4-ylpropyl)-3-(5,5,5-trifluoropentyl)guanidine;hydroiodide
CID 112431208
1-Cyclohexyl-2-(3,3,3-trifluoro-2-morpholin-4-ylpropyl)guanidine;hydroiodide
CID 120973862
1-Cyclohexyl-2-(3,3,3-trifluoro-2-morpholin-4-ylpropyl)guanidine
CID 120973863
N'-cyclohexylmorpholine-4-carboximidamide
CID 53863109
N'-cyclohexylmorpholine-4-carboximidamide
CID 53863109
N,N'-dicyclohexylmorpholin-4-ium-4-carboximidamide
CID 59981783
pentyl N-cyclohexyl-N'-(2-morpholin-4-ylethyl)carbamimidate
CID 66704392
N'-[2-(3-methylmorpholin-4-yl)propyl]azepane-1-carboximidamide
CID 86779265

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine?
The IUPAC name of 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine (CID 62367901) is 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine.
What is the SMILES notation for 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine?
The canonical SMILES for 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine is CC(CN1CCOCC1)N/C(N)=N/C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine?
The InChIKey is UKHVMOZTZODSRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-12(11-18-7-9-19-10-8-18)16-14(15)17-13-5-3-2-4-6-13/h12-13H,2-11H2,1H3,(H3,15,16,17).
What are the key properties of 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine?
2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine has a molecular weight of 268.40 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(1-morpholin-4-ylpropan-2-yl)guanidine is sourced from PubChem (CID 62367901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).