methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate

C14H18N2O5 — CID 78927066

IUPACmethyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate
SMILESCOC(=O)C1CN(C(=O)Nc2ccccc2OC)CCO1
InChIInChI=1S/C14H18N2O5/c1-19-11-6-4-3-5-10(11)15-14(18)16-7-8-21-12(9-16)13(17)20-2/h3-6,12H,7-9H2,1-2H3,(H,15,18)
InChIKeyUEOGOXYZVNGLHC-UHFFFAOYSA-N
MW294.31 g/mol
LogP1.10
Rot. Bonds3

About methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate

methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate (PubChem CID 78927066) has the molecular formula C14H18N2O5 and a molecular weight of 294.31 g/mol. Its IUPAC name is methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate.

Molecular Properties

Compound Namemethyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate
PubChem CID78927066
Molecular FormulaC14H18N2O5
Molecular Weight294.31 g/mol
Exact Mass294.12
IUPAC Namemethyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate
SMILESCOC(=O)C1CN(C(=O)Nc2ccccc2OC)CCO1
InChIInChI=1S/C14H18N2O5/c1-19-11-6-4-3-5-10(11)15-14(18)16-7-8-21-12(9-16)13(17)20-2/h3-6,12H,7-9H2,1-2H3,(H,15,18)
InChIKeyUEOGOXYZVNGLHC-UHFFFAOYSA-N
XLogP1.10
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate?
The IUPAC name of methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate (CID 78927066) is methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate.
What is the SMILES notation for methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate?
The canonical SMILES for methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate is COC(=O)C1CN(C(=O)Nc2ccccc2OC)CCO1.
What is the InChIKey of methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate?
The InChIKey is UEOGOXYZVNGLHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O5/c1-19-11-6-4-3-5-10(11)15-14(18)16-7-8-21-12(9-16)13(17)20-2/h3-6,12H,7-9H2,1-2H3,(H,15,18).
What are the key properties of methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate?
methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate has a molecular weight of 294.31 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate is sourced from PubChem (CID 78927066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).