methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate

C16H18N2O3 — CID 79764299

IUPACmethyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate
SMILESCOC(=O)CC1CN(c2ccc3ccccc3n2)CCO1
InChIInChI=1S/C16H18N2O3/c1-20-16(19)10-13-11-18(8-9-21-13)15-7-6-12-4-2-3-5-14(12)17-15/h2-7,13H,8-11H2,1H3
InChIKeyIZVFWEHIVWAYHL-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.00
Rot. Bonds3

About methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate

methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate (PubChem CID 79764299) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate.

Molecular Properties

Compound Namemethyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate
PubChem CID79764299
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Namemethyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate
SMILESCOC(=O)CC1CN(c2ccc3ccccc3n2)CCO1
InChIInChI=1S/C16H18N2O3/c1-20-16(19)10-13-11-18(8-9-21-13)15-7-6-12-4-2-3-5-14(12)17-15/h2-7,13H,8-11H2,1H3
InChIKeyIZVFWEHIVWAYHL-UHFFFAOYSA-N
XLogP2.00
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-quinolin-2-ylmorpholine-2-carboxylate
CID 78926263
methyl 2-(4-pyridin-2-ylmorpholin-2-yl)acetate
CID 71977884
4-quinolin-2-ylmorpholine-2-carboxamide
CID 133278543
methyl 2-[4-[5-(1-methylcyclopropyl)-2-pyridinyl]morpholin-2-yl]acetate
CID 167896835
methyl 2-[4-(4-phenyl-1,3-thiazol-2-yl)morpholin-2-yl]acetate
CID 154750161
methyl 2-[4-(3-bromo-2-pyridinyl)morpholin-2-yl]acetate
CID 115538633
methyl 2-[2-(2-methoxy-2-oxoethyl)morpholin-4-yl]pyridine-3-carboxylate
CID 115538646
methyl 2-[4-(3-carbamoyl-2-pyridinyl)morpholin-2-yl]acetate
CID 79770247
methyl 2-[4-(5,6-dimethyl-1,2,4-triazin-3-yl)morpholin-2-yl]acetate
CID 114448691
methyl 2-[(2R)-4-[(2R)-1-(1,3-benzothiazol-2-yl)propan-2-yl]morpholin-2-yl]acetate
CID 96548441
methyl 2-[4-(4-methylsulfonylphenyl)morpholin-2-yl]acetate
CID 115538670
1-[2-(2-methoxy-2-oxoethyl)morpholine-4-carbonyl]azetidine-3-carboxylic acid
CID 115535465

Frequently Asked Questions

What is the IUPAC name of methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate?
The IUPAC name of methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate (CID 79764299) is methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate.
What is the SMILES notation for methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate?
The canonical SMILES for methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate is COC(=O)CC1CN(c2ccc3ccccc3n2)CCO1.
What is the InChIKey of methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate?
The InChIKey is IZVFWEHIVWAYHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-20-16(19)10-13-11-18(8-9-21-13)15-7-6-12-4-2-3-5-14(12)17-15/h2-7,13H,8-11H2,1H3.
What are the key properties of methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate?
methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate has a molecular weight of 286.33 g/mol, XLogP of 2.00, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(4-quinolin-2-ylmorpholin-2-yl)acetate is sourced from PubChem (CID 79764299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).