2-morpholin-4-ylethyl cyclohexanecarboxylate

C13H23NO3 — CID 21150298

IUPAC2-morpholin-4-ylethyl cyclohexanecarboxylate
SMILESO=C(OCCN1CCOCC1)C1CCCCC1
InChIInChI=1S/C13H23NO3/c15-13(12-4-2-1-3-5-12)17-11-8-14-6-9-16-10-7-14/h12H,1-11H2
InChIKeySXEHNUFAMUORRF-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.44
Rot. Bonds4

About 2-morpholin-4-ylethyl cyclohexanecarboxylate

2-morpholin-4-ylethyl cyclohexanecarboxylate (PubChem CID 21150298) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-morpholin-4-ylethyl cyclohexanecarboxylate.

Molecular Properties

Compound Name2-morpholin-4-ylethyl cyclohexanecarboxylate
PubChem CID21150298
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC Name2-morpholin-4-ylethyl cyclohexanecarboxylate
SMILESO=C(OCCN1CCOCC1)C1CCCCC1
InChIInChI=1S/C13H23NO3/c15-13(12-4-2-1-3-5-12)17-11-8-14-6-9-16-10-7-14/h12H,1-11H2
InChIKeySXEHNUFAMUORRF-UHFFFAOYSA-N
XLogP1.44
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-morpholin-4-ylethyl piperidine-4-carboxylate;hydrochloride
CID 118522364
2-morpholin-4-ylethyl 1-ethylpiperidine-4-carboxylate
CID 118534909
4-morpholin-4-ylbut-2-ynyl cyclohexanecarboxylate
CID 11976488
[(2R)-2-amino-3-(4-morpholin-4-ylbutoxy)-3-oxopropyl]sulfanylcarbonyloxymethyl cyclohexanecarboxylate
CID 142436597
2-morpholin-4-ylethyl bicyclo[2.2.1]heptane-2-carboxylate
CID 59204120
N-(2-morpholin-4-ylethoxy)cyclopropanecarboxamide
CID 110642742
bis(2-morpholin-4-ylethyl) but-2-enedioate
CID 69032977
2-O-(2-methoxyethyl) 1-O-(2-piperidin-1-ylethyl) cyclohexane-1,2-dicarboxylate
CID 164933243
2-morpholin-4-ylethyl 2-bromoacetate
CID 118035535
2-pyrrolidin-1-ylethyl 1-methylpiperidine-2-carboxylate
CID 23176009
2-morpholin-4-ylethyl 2,2-dimethylpropanoate;3-piperidin-1-ylpropyl 2,2-dimethylpropanoate
CID 158258538
methyl (3S)-1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate
CID 79037896

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylethyl cyclohexanecarboxylate?
The IUPAC name of 2-morpholin-4-ylethyl cyclohexanecarboxylate (CID 21150298) is 2-morpholin-4-ylethyl cyclohexanecarboxylate.
What is the SMILES notation for 2-morpholin-4-ylethyl cyclohexanecarboxylate?
The canonical SMILES for 2-morpholin-4-ylethyl cyclohexanecarboxylate is O=C(OCCN1CCOCC1)C1CCCCC1.
What is the InChIKey of 2-morpholin-4-ylethyl cyclohexanecarboxylate?
The InChIKey is SXEHNUFAMUORRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c15-13(12-4-2-1-3-5-12)17-11-8-14-6-9-16-10-7-14/h12H,1-11H2.
What are the key properties of 2-morpholin-4-ylethyl cyclohexanecarboxylate?
2-morpholin-4-ylethyl cyclohexanecarboxylate has a molecular weight of 241.33 g/mol, XLogP of 1.44, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylethyl cyclohexanecarboxylate is sourced from PubChem (CID 21150298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).