cycloheptyl-(4-ethylmorpholin-2-yl)methanone

C14H25NO2 — CID 82931691

IUPACcycloheptyl-(4-ethylmorpholin-2-yl)methanone
SMILESCCN1CCOC(C(=O)C2CCCCCC2)C1
InChIInChI=1S/C14H25NO2/c1-2-15-9-10-17-13(11-15)14(16)12-7-5-3-4-6-8-12/h12-13H,2-11H2,1H3
InChIKeyXSOQDGKNZIVKBI-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.25
Rot. Bonds3

About cycloheptyl-(4-ethylmorpholin-2-yl)methanone

cycloheptyl-(4-ethylmorpholin-2-yl)methanone (PubChem CID 82931691) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is cycloheptyl-(4-ethylmorpholin-2-yl)methanone.

Molecular Properties

Compound Namecycloheptyl-(4-ethylmorpholin-2-yl)methanone
PubChem CID82931691
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Namecycloheptyl-(4-ethylmorpholin-2-yl)methanone
SMILESCCN1CCOC(C(=O)C2CCCCCC2)C1
InChIInChI=1S/C14H25NO2/c1-2-15-9-10-17-13(11-15)14(16)12-7-5-3-4-6-8-12/h12-13H,2-11H2,1H3
InChIKeyXSOQDGKNZIVKBI-UHFFFAOYSA-N
XLogP2.25
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

cyclohexyl-(4-propylmorpholin-2-yl)methanone
CID 79669542
4-ethylmorpholine-2-carboxylate
CID 127053688
[(2R)-2-(aminomethyl)piperidin-1-yl]-[(2S)-4-ethylmorpholin-2-yl]methanone
CID 129414733
methyl 4-ethylmorpholine-2-carboxylate
CID 78926280
1-(4-ethylmorpholin-2-yl)-2-methylbutan-1-one
CID 79666840
N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride
CID 119477299
3,9-diazabicyclo[4.2.1]nonan-3-yl-(4-ethylmorpholin-2-yl)methanone;dihydrochloride
CID 119637717
ethane;4-ethyl-2-prop-1-en-2-ylmorpholine
CID 177135934
[3-(1-aminoethyl)piperidin-1-yl]-(4-ethylmorpholin-2-yl)methanone;dihydrochloride
CID 119595248
4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride
CID 119507639
4-ethyl-N-[2-(methylamino)ethyl]morpholine-2-carboxamide
CID 119502673
(3,5-dimethylphenyl)-(4-ethylmorpholin-2-yl)methanone
CID 79667186

Frequently Asked Questions

What is the IUPAC name of cycloheptyl-(4-ethylmorpholin-2-yl)methanone?
The IUPAC name of cycloheptyl-(4-ethylmorpholin-2-yl)methanone (CID 82931691) is cycloheptyl-(4-ethylmorpholin-2-yl)methanone.
What is the SMILES notation for cycloheptyl-(4-ethylmorpholin-2-yl)methanone?
The canonical SMILES for cycloheptyl-(4-ethylmorpholin-2-yl)methanone is CCN1CCOC(C(=O)C2CCCCCC2)C1.
What is the InChIKey of cycloheptyl-(4-ethylmorpholin-2-yl)methanone?
The InChIKey is XSOQDGKNZIVKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-2-15-9-10-17-13(11-15)14(16)12-7-5-3-4-6-8-12/h12-13H,2-11H2,1H3.
What are the key properties of cycloheptyl-(4-ethylmorpholin-2-yl)methanone?
cycloheptyl-(4-ethylmorpholin-2-yl)methanone has a molecular weight of 239.36 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptyl-(4-ethylmorpholin-2-yl)methanone is sourced from PubChem (CID 82931691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).