[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone

C14H23NO3 — CID 166238347

IUPAC[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone
SMILESCOCC1CN(C(=O)C2CC23CC3)CC(C)(C)O1
InChIInChI=1S/C14H23NO3/c1-13(2)9-15(7-10(18-13)8-17-3)12(16)11-6-14(11)4-5-14/h10-11H,4-9H2,1-3H3
InChIKeyVQMMJMWSXQQVRJ-UHFFFAOYSA-N
MW253.34 g/mol
LogP1.44
Rot. Bonds3

About [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone

[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone (PubChem CID 166238347) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone.

Molecular Properties

Compound Name[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone
PubChem CID166238347
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone
SMILESCOCC1CN(C(=O)C2CC23CC3)CC(C)(C)O1
InChIInChI=1S/C14H23NO3/c1-13(2)9-15(7-10(18-13)8-17-3)12(16)11-6-14(11)4-5-14/h10-11H,4-9H2,1-3H3
InChIKeyVQMMJMWSXQQVRJ-UHFFFAOYSA-N
XLogP1.44
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[6-(methoxymethyl)-2,2-dimethylmorpholine-4-carbonyl]azetidin-1-yl]ethanone
CID 128978793
2-methoxy-1-[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]ethanone
CID 129351165
furan-3-yl-[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 129485837
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-[4-(methoxymethyl)phenyl]methanone
CID 129485960
(5-hydroxy-3-pyridinyl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 128978801
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(6-methyl-3-pyridinyl)methanone
CID 129485933
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(5-methylfuran-2-yl)methanone
CID 129484541
(3,5-dimethylfuran-2-yl)-[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 128978502
(4-cyclopropyl-2-methylpyrimidin-5-yl)-[(6S)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 129484599
1-[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-3-(1,2,4-triazol-1-yl)propan-1-one
CID 129351171
1-[(6S)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-2-phenoxyethanone
CID 129485528
[(6R)-6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-(1-methyl-3-propan-2-ylpyrazol-4-yl)methanone
CID 129485236

Frequently Asked Questions

What is the IUPAC name of [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone?
The IUPAC name of [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone (CID 166238347) is [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone.
What is the SMILES notation for [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone?
The canonical SMILES for [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone is COCC1CN(C(=O)C2CC23CC3)CC(C)(C)O1.
What is the InChIKey of [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone?
The InChIKey is VQMMJMWSXQQVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-13(2)9-15(7-10(18-13)8-17-3)12(16)11-6-14(11)4-5-14/h10-11H,4-9H2,1-3H3.
What are the key properties of [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone?
[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone has a molecular weight of 253.34 g/mol, XLogP of 1.44, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]-spiro[2.2]pentan-2-ylmethanone is sourced from PubChem (CID 166238347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).