morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone

C14H23NO2 — CID 138722432

IUPACmorpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone
SMILESCC(C)C1=CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C14H23NO2/c1-11(2)12-3-5-13(6-4-12)14(16)15-7-9-17-10-8-15/h3,11,13H,4-10H2,1-2H3
InChIKeyRAHCAGJSAAPJBT-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.23
Rot. Bonds2

About morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone

morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone (PubChem CID 138722432) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone
PubChem CID138722432
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Namemorpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone
SMILESCC(C)C1=CCC(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C14H23NO2/c1-11(2)12-3-5-13(6-4-12)14(16)15-7-9-17-10-8-15/h3,11,13H,4-10H2,1-2H3
InChIKeyRAHCAGJSAAPJBT-UHFFFAOYSA-N
XLogP2.23
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4-ethylcyclohex-3-en-1-yl)-morpholin-4-ylmethanone
CID 138722431
[(3S)-oxolan-3-yl]-(4-propan-2-yl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 176865071
morpholin-4-yl-[1-(4-propan-2-ylphenyl)piperidin-4-yl]methanone
CID 166901168
1-[4-[4-(morpholine-4-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 109146746
[1-(2-hydroxy-4-propan-2-ylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 47051901
[1-(2-methylpropyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 883920
morpholin-4-yl-[4-[6-[[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-4-yl]methoxy]-3-pyridinyl]cyclohex-3-en-1-yl]methanone
CID 129104922
1-[4-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
CID 110604424
4-methyl-1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-3-phenylpentan-1-one
CID 110620002
cyclopropyl-[4-(morpholine-4-carbonyl)piperazin-1-yl]methanone
CID 110346881
(4-methylpiperidin-1-yl)-(oxan-4-yl)methanone
CID 78803278
3-(morpholine-4-carbonyl)cyclohexane-1-carboxylic acid
CID 63789770

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone?
The IUPAC name of morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone (CID 138722432) is morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone?
The canonical SMILES for morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone is CC(C)C1=CCC(C(=O)N2CCOCC2)CC1.
What is the InChIKey of morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone?
The InChIKey is RAHCAGJSAAPJBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-11(2)12-3-5-13(6-4-12)14(16)15-7-9-17-10-8-15/h3,11,13H,4-10H2,1-2H3.
What are the key properties of morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone?
morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone has a molecular weight of 237.34 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(4-propan-2-ylcyclohex-3-en-1-yl)methanone is sourced from PubChem (CID 138722432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).