4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine

C10H19NO3 — CID 3719886

IUPAC4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine
SMILESCC1(C)OCC(CN2CCOCC2)O1
InChIInChI=1S/C10H19NO3/c1-10(2)13-8-9(14-10)7-11-3-5-12-6-4-11/h9H,3-8H2,1-2H3
InChIKeyANRHASPMHMBCDM-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.47
Rot. Bonds2

About 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine

4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine (PubChem CID 3719886) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine
PubChem CID3719886
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine
SMILESCC1(C)OCC(CN2CCOCC2)O1
InChIInChI=1S/C10H19NO3/c1-10(2)13-8-9(14-10)7-11-3-5-12-6-4-11/h9H,3-8H2,1-2H3
InChIKeyANRHASPMHMBCDM-UHFFFAOYSA-N
XLogP0.47
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(+)-cis-Dioxolane iodide
CID 657346
1,3-Dioxolane-4-methanaminium, N,N,N,2-tetramethyl-, iodide (1:1)
CID 20410
(+)-cis-Dioxolane
CID 657347
Trimethyl-[(2-methyl-1,3-dioxolan-4-yl)methyl]azanium
CID 20411
(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl-(2-hydroxyethyl)-dimethylazanium bromide
CID 14522795
N,N,N-Trimethyl-1,3-dioxolane-4-methanaminium
CID 10940
trimethyl-[[(2R,4R)-2-methyl-1,3-dioxolan-4-yl]methyl]azanium iodide
CID 12246114
[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-(2-hydroxyethyl)-dimethylazanium bromide
CID 44386524
trimethyl-[[(2S,4S)-2-methyl-1,3-dioxolan-4-yl]methyl]azanium iodide
CID 44422685
1-Methyl-1-{[2-methyl-2-(2-methylpropyl)-1,3-dioxolan-4-yl]methyl}piperidinium
CID 4257363
4-((2,2-Dibutyl-1,3,2-dioxastannolan-4-yl)methyl)morpholine
CID 16683176
4-(1,4-Dioxaspiro[4.4]non-2-ylmethyl)morpholine
CID 2910612

Frequently Asked Questions

What is the IUPAC name of 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine?
The IUPAC name of 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine (CID 3719886) is 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine.
What is the SMILES notation for 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine?
The canonical SMILES for 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine is CC1(C)OCC(CN2CCOCC2)O1.
What is the InChIKey of 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine?
The InChIKey is ANRHASPMHMBCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-10(2)13-8-9(14-10)7-11-3-5-12-6-4-11/h9H,3-8H2,1-2H3.
What are the key properties of 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine?
4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine has a molecular weight of 201.27 g/mol, XLogP of 0.47, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]morpholine is sourced from PubChem (CID 3719886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).