N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane

C21H42N2O3 — CID 158754691

IUPACN-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane
SMILESC.CCCCCCCC(=O)N(OCCN1CCOCC1)C1CCCCC1
InChIInChI=1S/C20H38N2O3.CH4/c1-2-3-4-5-9-12-20(23)22(19-10-7-6-8-11-19)25-18-15-21-13-16-24-17-14-21;/h19H,2-18H2,1H3;1H4
InChIKeyINXMQGVCWCYQAU-UHFFFAOYSA-N
MW370.58 g/mol
LogP4.41
Rot. Bonds11

About N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane

N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane (PubChem CID 158754691) has the molecular formula C21H42N2O3 and a molecular weight of 370.58 g/mol. Its IUPAC name is N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane.

Molecular Properties

Compound NameN-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane
PubChem CID158754691
Molecular FormulaC21H42N2O3
Molecular Weight370.58 g/mol
Exact Mass370.32
IUPAC NameN-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane
SMILESC.CCCCCCCC(=O)N(OCCN1CCOCC1)C1CCCCC1
InChIInChI=1S/C20H38N2O3.CH4/c1-2-3-4-5-9-12-20(23)22(19-10-7-6-8-11-19)25-18-15-21-13-16-24-17-14-21;/h19H,2-18H2,1H3;1H4
InChIKeyINXMQGVCWCYQAU-UHFFFAOYSA-N
XLogP4.41
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.58
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-N-[2-(methylamino)ethoxy]octanamide
CID 170293250
N,N-dicyclohexyl-5-morpholin-4-ylpentanamide
CID 67746963
3-(5-aminopentyl)-1-cyclohexyl-1-(2-morpholin-4-ylethoxy)urea
CID 87236961
2-morpholin-4-ylethyl octanoate
CID 23118480
ethyl N-cyclohexyl-N-octadecoxycarbamate
CID 149251240
4-(2-hexoxyethyl)morpholine
CID 3326674
4-hexyl-1,4-oxazepane
CID 166849903
N-(2-morpholin-4-ylethoxy)hexanamide
CID 87298881
4-hexylmorpholine
CID 3614751
tetradecyl 3-morpholin-4-ylpropanoate
CID 59204007
N-(2-chloroethyl)-N-cyclohexyloctanamide
CID 63391554
6-amino-N-cyclohexyl-N-(2-morpholin-4-ylethoxy)hexane-1-sulfonamide
CID 72735790

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane?
The IUPAC name of N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane (CID 158754691) is N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane.
What is the SMILES notation for N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane?
The canonical SMILES for N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane is C.CCCCCCCC(=O)N(OCCN1CCOCC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane?
The InChIKey is INXMQGVCWCYQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38N2O3.CH4/c1-2-3-4-5-9-12-20(23)22(19-10-7-6-8-11-19)25-18-15-21-13-16-24-17-14-21;/h19H,2-18H2,1H3;1H4.
What are the key properties of N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane?
N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane has a molecular weight of 370.58 g/mol, XLogP of 4.41, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(2-morpholin-4-ylethoxy)octanamide;methane is sourced from PubChem (CID 158754691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).