ethyl 2-(2-methylphenyl)morpholine-4-carboxylate

C14H19NO3 — CID 71684137

IUPACethyl 2-(2-methylphenyl)morpholine-4-carboxylate
SMILESCCOC(=O)N1CCOC(c2ccccc2C)C1
InChIInChI=1S/C14H19NO3/c1-3-17-14(16)15-8-9-18-13(10-15)12-7-5-4-6-11(12)2/h4-7,13H,3,8-10H2,1-2H3
InChIKeyAHTUEDVZTOHLLE-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.52
Rot. Bonds2

About ethyl 2-(2-methylphenyl)morpholine-4-carboxylate

ethyl 2-(2-methylphenyl)morpholine-4-carboxylate (PubChem CID 71684137) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is ethyl 2-(2-methylphenyl)morpholine-4-carboxylate.

Molecular Properties

Compound Nameethyl 2-(2-methylphenyl)morpholine-4-carboxylate
PubChem CID71684137
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Nameethyl 2-(2-methylphenyl)morpholine-4-carboxylate
SMILESCCOC(=O)N1CCOC(c2ccccc2C)C1
InChIInChI=1S/C14H19NO3/c1-3-17-14(16)15-8-9-18-13(10-15)12-7-5-4-6-11(12)2/h4-7,13H,3,8-10H2,1-2H3
InChIKeyAHTUEDVZTOHLLE-UHFFFAOYSA-N
XLogP2.52
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-methyl-1-[2-(2-methylphenyl)morpholin-4-yl]butan-1-one
CID 126789841
2-(4-ethoxyphenyl)-1-[2-(2-methylphenyl)morpholin-4-yl]ethanone
CID 110364487
2-(1-aminocyclobutyl)-1-[(2S)-2-(2-methylphenyl)morpholin-4-yl]ethanone
CID 124696262
(2S)-2-amino-1-[(2R)-2-(2-methylphenyl)morpholin-4-yl]-4-methylsulfanylbutan-1-one
CID 124595664
2-(2-methoxyphenoxy)-1-[2-(2-methylphenyl)morpholin-4-yl]ethanone
CID 110364507
[2-(2-methylphenyl)morpholin-4-yl]-(oxolan-2-yl)methanone
CID 110364459
(2R)-N-(3-methoxypropyl)-N-methyl-2-(2-methylphenyl)morpholine-4-carboxamide
CID 99858293
2-[[ethylamino-[2-(2-methylphenyl)morpholin-4-yl]methylidene]amino]-N,N-dimethylacetamide
CID 109480637
ethyl 2-(4-propan-2-ylphenyl)morpholine-4-carboxylate
CID 110364133
N-(4-chlorophenyl)-2-(2-methylphenyl)morpholine-4-carboxamide
CID 110364497
[(1R,3S)-3-aminocyclohexyl]-[(2R)-2-(2-methylphenyl)morpholin-4-yl]methanone
CID 125153639
N,N-dimethyl-2-[[[2-(2-methylphenyl)morpholin-4-yl]-(propylamino)methylidene]amino]acetamide
CID 110043665

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-methylphenyl)morpholine-4-carboxylate?
The IUPAC name of ethyl 2-(2-methylphenyl)morpholine-4-carboxylate (CID 71684137) is ethyl 2-(2-methylphenyl)morpholine-4-carboxylate.
What is the SMILES notation for ethyl 2-(2-methylphenyl)morpholine-4-carboxylate?
The canonical SMILES for ethyl 2-(2-methylphenyl)morpholine-4-carboxylate is CCOC(=O)N1CCOC(c2ccccc2C)C1.
What is the InChIKey of ethyl 2-(2-methylphenyl)morpholine-4-carboxylate?
The InChIKey is AHTUEDVZTOHLLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-3-17-14(16)15-8-9-18-13(10-15)12-7-5-4-6-11(12)2/h4-7,13H,3,8-10H2,1-2H3.
What are the key properties of ethyl 2-(2-methylphenyl)morpholine-4-carboxylate?
ethyl 2-(2-methylphenyl)morpholine-4-carboxylate has a molecular weight of 249.31 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-methylphenyl)morpholine-4-carboxylate is sourced from PubChem (CID 71684137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).