methyl 4-quinolin-2-ylmorpholine-2-carboxylate

C15H16N2O3 — CID 78926263

IUPACmethyl 4-quinolin-2-ylmorpholine-2-carboxylate
SMILESCOC(=O)C1CN(c2ccc3ccccc3n2)CCO1
InChIInChI=1S/C15H16N2O3/c1-19-15(18)13-10-17(8-9-20-13)14-7-6-11-4-2-3-5-12(11)16-14/h2-7,13H,8-10H2,1H3
InChIKeyYGFZKOZJMKTUQZ-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.61
Rot. Bonds2

About methyl 4-quinolin-2-ylmorpholine-2-carboxylate

methyl 4-quinolin-2-ylmorpholine-2-carboxylate (PubChem CID 78926263) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is methyl 4-quinolin-2-ylmorpholine-2-carboxylate.

Molecular Properties

Compound Namemethyl 4-quinolin-2-ylmorpholine-2-carboxylate
PubChem CID78926263
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Namemethyl 4-quinolin-2-ylmorpholine-2-carboxylate
SMILESCOC(=O)C1CN(c2ccc3ccccc3n2)CCO1
InChIInChI=1S/C15H16N2O3/c1-19-15(18)13-10-17(8-9-20-13)14-7-6-11-4-2-3-5-12(11)16-14/h2-7,13H,8-10H2,1H3
InChIKeyYGFZKOZJMKTUQZ-UHFFFAOYSA-N
XLogP1.61
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 4-quinolin-2-ylmorpholine-2-carboxylate?
The IUPAC name of methyl 4-quinolin-2-ylmorpholine-2-carboxylate (CID 78926263) is methyl 4-quinolin-2-ylmorpholine-2-carboxylate.
What is the SMILES notation for methyl 4-quinolin-2-ylmorpholine-2-carboxylate?
The canonical SMILES for methyl 4-quinolin-2-ylmorpholine-2-carboxylate is COC(=O)C1CN(c2ccc3ccccc3n2)CCO1.
What is the InChIKey of methyl 4-quinolin-2-ylmorpholine-2-carboxylate?
The InChIKey is YGFZKOZJMKTUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-19-15(18)13-10-17(8-9-20-13)14-7-6-11-4-2-3-5-12(11)16-14/h2-7,13H,8-10H2,1H3.
What are the key properties of methyl 4-quinolin-2-ylmorpholine-2-carboxylate?
methyl 4-quinolin-2-ylmorpholine-2-carboxylate has a molecular weight of 272.30 g/mol, XLogP of 1.61, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-quinolin-2-ylmorpholine-2-carboxylate is sourced from PubChem (CID 78926263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).