N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide

C14H22N2O3 — CID 19133522

IUPACN-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
SMILESCCNC(=O)C1CC=CCC1C(=O)N1CCOCC1
InChIInChI=1S/C14H22N2O3/c1-2-15-13(17)11-5-3-4-6-12(11)14(18)16-7-9-19-10-8-16/h3-4,11-12H,2,5-10H2,1H3,(H,15,17)
InChIKeyHLOQMYINOIXUKL-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.56
Rot. Bonds3

About N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide

N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide (PubChem CID 19133522) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
PubChem CID19133522
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
SMILESCCNC(=O)C1CC=CCC1C(=O)N1CCOCC1
InChIInChI=1S/C14H22N2O3/c1-2-15-13(17)11-5-3-4-6-12(11)14(18)16-7-9-19-10-8-16/h3-4,11-12H,2,5-10H2,1H3,(H,15,17)
InChIKeyHLOQMYINOIXUKL-UHFFFAOYSA-N
XLogP0.56
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1S,6S)-N-hex-5-ynyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
CID 99829878
(1S,6S)-N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
CID 99778519
N-(4-acetylphenyl)-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
CID 19133552
2-N-ethylcyclohex-4-ene-1,2-dicarboxamide
CID 123699570
(1R,6S)-6-(ethylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
CID 40538429
2-(morpholine-4-carbonyl)-N-propylcyclopropane-1-carboxamide
CID 109130430
[(1R,6R)-6-[(3S,4R)-3,4-dimethylpiperidine-1-carbonyl]cyclohex-3-en-1-yl]-morpholin-4-ylmethanone
CID 129430953
(1S,6R)-N-(2-methyl-4-pyridinyl)-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
CID 124621745
N-[1-(2-fluorophenyl)propan-2-yl]-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
CID 136534481
(1S,6R)-6-(morpholine-4-carbonyl)-N-(4-sulfamoylphenyl)cyclohex-3-ene-1-carboxamide
CID 1125531
(1R,6S)-N-(3-hydroxy-2-pyridinyl)-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide
CID 129477988
(1R,6S)-N-methyl-6-(piperidine-1-carbonyl)cyclohex-3-ene-1-carboxamide
CID 93083461

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide?
The IUPAC name of N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide (CID 19133522) is N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide.
What is the SMILES notation for N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide?
The canonical SMILES for N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide is CCNC(=O)C1CC=CCC1C(=O)N1CCOCC1.
What is the InChIKey of N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide?
The InChIKey is HLOQMYINOIXUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-2-15-13(17)11-5-3-4-6-12(11)14(18)16-7-9-19-10-8-16/h3-4,11-12H,2,5-10H2,1H3,(H,15,17).
What are the key properties of N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide?
N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(morpholine-4-carbonyl)cyclohex-3-ene-1-carboxamide is sourced from PubChem (CID 19133522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).