[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone

C18H22N2O3 — CID 128978468

IUPAC[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone
SMILESCOCC1CN(C(=O)c2ccc3ncccc3c2)CC(C)(C)O1
InChIInChI=1S/C18H22N2O3/c1-18(2)12-20(10-15(23-18)11-22-3)17(21)14-6-7-16-13(9-14)5-4-8-19-16/h4-9,15H,10-12H2,1-3H3
InChIKeyRDXUEZRQYJLLNA-UHFFFAOYSA-N
MW314.38 g/mol
LogP2.50
Rot. Bonds3

About [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone

[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone (PubChem CID 128978468) has the molecular formula C18H22N2O3 and a molecular weight of 314.38 g/mol. Its IUPAC name is [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone.

Molecular Properties

Compound Name[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone
PubChem CID128978468
Molecular FormulaC18H22N2O3
Molecular Weight314.38 g/mol
Exact Mass314.16
IUPAC Name[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone
SMILESCOCC1CN(C(=O)c2ccc3ncccc3c2)CC(C)(C)O1
InChIInChI=1S/C18H22N2O3/c1-18(2)12-20(10-15(23-18)11-22-3)17(21)14-6-7-16-13(9-14)5-4-8-19-16/h4-9,15H,10-12H2,1-3H3
InChIKeyRDXUEZRQYJLLNA-UHFFFAOYSA-N
XLogP2.50
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(6-methyl-3-pyridinyl)methanone
CID 129485933
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(2-methyl-1,3-benzoxazol-5-yl)methanone
CID 129484739
3-[(6S)-6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]benzonitrile
CID 129485781
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-[4-(methoxymethyl)phenyl]methanone
CID 129485960
4-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-1H-pyridin-2-one
CID 128978783
[(6S)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-[3-(triazol-1-yl)phenyl]methanone
CID 129484539
1-[(6S)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-2-quinolin-3-ylethanone
CID 129484445
1-[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-2-quinolin-3-ylethanone
CID 129484446
(5-hydroxy-3-pyridinyl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 128978801
furan-3-yl-[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 129485837
[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-[4-(5-methylpyrazol-1-yl)phenyl]methanone
CID 128978537
[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-[4-(triazol-1-yl)phenyl]methanone
CID 128978746

Frequently Asked Questions

What is the IUPAC name of [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone?
The IUPAC name of [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone (CID 128978468) is [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone.
What is the SMILES notation for [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone?
The canonical SMILES for [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone is COCC1CN(C(=O)c2ccc3ncccc3c2)CC(C)(C)O1.
What is the InChIKey of [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone?
The InChIKey is RDXUEZRQYJLLNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-18(2)12-20(10-15(23-18)11-22-3)17(21)14-6-7-16-13(9-14)5-4-8-19-16/h4-9,15H,10-12H2,1-3H3.
What are the key properties of [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone?
[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone has a molecular weight of 314.38 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-quinolin-6-ylmethanone is sourced from PubChem (CID 128978468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).