ethane;3-ethyl-4-(oxetan-3-yl)morpholine

C11H23NO2 — CID 177200740

IUPACethane;3-ethyl-4-(oxetan-3-yl)morpholine
SMILESCC.CCC1COCCN1C1COC1
InChIInChI=1S/C9H17NO2.C2H6/c1-2-8-5-11-4-3-10(8)9-6-12-7-9;1-2/h8-9H,2-7H2,1H3;1-2H3
InChIKeyRFDFRPXRLOWAPR-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.52
Rot. Bonds2

About ethane;3-ethyl-4-(oxetan-3-yl)morpholine

ethane;3-ethyl-4-(oxetan-3-yl)morpholine (PubChem CID 177200740) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is ethane;3-ethyl-4-(oxetan-3-yl)morpholine.

Molecular Properties

Compound Nameethane;3-ethyl-4-(oxetan-3-yl)morpholine
PubChem CID177200740
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Nameethane;3-ethyl-4-(oxetan-3-yl)morpholine
SMILESCC.CCC1COCCN1C1COC1
InChIInChI=1S/C9H17NO2.C2H6/c1-2-8-5-11-4-3-10(8)9-6-12-7-9;1-2/h8-9H,2-7H2,1H3;1-2H3
InChIKeyRFDFRPXRLOWAPR-UHFFFAOYSA-N
XLogP1.52
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-ethyl-4-methylmorpholine
CID 130351596
[(6R)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-6-yl]methanol;ethane
CID 177330814
trans-(1S,2S)-2-(3-ethylmorpholin-4-yl)cyclohexan-1-ol
CID 102731928
1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile
CID 79638552
4-(3-bromopropyl)-3-ethylmorpholine
CID 61288372
3-ethyl-4-[(1-fluorocyclopropyl)methyl]morpholine
CID 131155594
2-(3-ethylmorpholin-4-yl)-N,3,5-trimethylcyclohexan-1-amine
CID 64752115
2-(3-ethylmorpholin-4-yl)-4-methylcyclohexane-1-carboxylic acid
CID 63067425
4-[4-(bromomethyl)phenyl]-3-ethylmorpholine
CID 107080615
4-(3-bromo-2-methylpropyl)-3-ethylmorpholine
CID 64996341
4-(9-bromononyl)-3-ethylmorpholine
CID 105343626
1-(4-cyclohexylmorpholin-3-yl)-N-methylmethanamine
CID 83100142

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethyl-4-(oxetan-3-yl)morpholine?
The IUPAC name of ethane;3-ethyl-4-(oxetan-3-yl)morpholine (CID 177200740) is ethane;3-ethyl-4-(oxetan-3-yl)morpholine.
What is the SMILES notation for ethane;3-ethyl-4-(oxetan-3-yl)morpholine?
The canonical SMILES for ethane;3-ethyl-4-(oxetan-3-yl)morpholine is CC.CCC1COCCN1C1COC1.
What is the InChIKey of ethane;3-ethyl-4-(oxetan-3-yl)morpholine?
The InChIKey is RFDFRPXRLOWAPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2.C2H6/c1-2-8-5-11-4-3-10(8)9-6-12-7-9;1-2/h8-9H,2-7H2,1H3;1-2H3.
What are the key properties of ethane;3-ethyl-4-(oxetan-3-yl)morpholine?
ethane;3-ethyl-4-(oxetan-3-yl)morpholine has a molecular weight of 201.31 g/mol, XLogP of 1.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethyl-4-(oxetan-3-yl)morpholine is sourced from PubChem (CID 177200740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).