2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate

C14H25NO4 — CID 3053872

IUPAC2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate
SMILESO=C(CC1(O)CCCCC1)OCCN1CCOCC1
InChIInChI=1S/C14H25NO4/c16-13(12-14(17)4-2-1-3-5-14)19-11-8-15-6-9-18-10-7-15/h17H,1-12H2
InChIKeyVKKMHDITCWRMEG-UHFFFAOYSA-N
MW271.36 g/mol
LogP0.95
Rot. Bonds5

About 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate

2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate (PubChem CID 3053872) has the molecular formula C14H25NO4 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate.

Molecular Properties

Compound Name2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate
PubChem CID3053872
Molecular FormulaC14H25NO4
Molecular Weight271.36 g/mol
Exact Mass271.18
IUPAC Name2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate
SMILESO=C(CC1(O)CCCCC1)OCCN1CCOCC1
InChIInChI=1S/C14H25NO4/c16-13(12-14(17)4-2-1-3-5-14)19-11-8-15-6-9-18-10-7-15/h17H,1-12H2
InChIKeyVKKMHDITCWRMEG-UHFFFAOYSA-N
XLogP0.95
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-morpholin-4-ylethyl 2-bromoacetate
CID 118035535
2-(4-methylmorpholin-4-ium-4-yl)ethyl 2-(1-hydroxycyclohexyl)acetate iodide
CID 3053875
2-morpholin-4-ylethyl but-3-enoate
CID 163582404
2-morpholin-4-ylethyl 3,3,3-trifluoropropanoate
CID 166930136
2-(1-hydroxycyclohexyl)-1-[4-(2-morpholin-4-ylethyl)piperidin-1-yl]ethanone
CID 75423557
2-morpholin-4-ylethyl cyclohexanecarboxylate
CID 21150298
bis(2-morpholin-4-ylethyl) but-2-enedioate
CID 69032977
2-morpholin-4-ylethyl 4-methylpiperidine-4-carboxylate;hydrochloride
CID 118522513
2-morpholin-4-ylethyl octanoate
CID 23118480
2-[16-[2-(4,4-dimethylpentanoyloxy)ethyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]ethyl 4,4-dimethylpentanoate
CID 102070429
2-pyrrolidin-1-ylethyl 1-hydroxycycloheptane-1-carboxylate
CID 3046846
ethane;2-morpholin-4-ylethyl 2-methylpropanoate
CID 156731056

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate?
The IUPAC name of 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate (CID 3053872) is 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate.
What is the SMILES notation for 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate?
The canonical SMILES for 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate is O=C(CC1(O)CCCCC1)OCCN1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate?
The InChIKey is VKKMHDITCWRMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO4/c16-13(12-14(17)4-2-1-3-5-14)19-11-8-15-6-9-18-10-7-15/h17H,1-12H2.
What are the key properties of 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate?
2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate has a molecular weight of 271.36 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate is sourced from PubChem (CID 3053872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).