3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine

C13H28N2O2 — CID 116500776

IUPAC3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine
SMILESCOCC(C)CNCC(C)(C)N1CCOCC1
InChIInChI=1S/C13H28N2O2/c1-12(10-16-4)9-14-11-13(2,3)15-5-7-17-8-6-15/h12,14H,5-11H2,1-4H3
InChIKeyXSGUSYSTMBVMTK-UHFFFAOYSA-N
MW244.38 g/mol
LogP0.97
Rot. Bonds7

About 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine

3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine (PubChem CID 116500776) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine.

Molecular Properties

Compound Name3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine
PubChem CID116500776
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine
SMILESCOCC(C)CNCC(C)(C)N1CCOCC1
InChIInChI=1S/C13H28N2O2/c1-12(10-16-4)9-14-11-13(2,3)15-5-7-17-8-6-15/h12,14H,5-11H2,1-4H3
InChIKeyXSGUSYSTMBVMTK-UHFFFAOYSA-N
XLogP0.97
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methyl-1-(morpholin-4-yl)propan-2-amine
CID 201497
2-Methyl-2-(morpholin-4-yl)propan-1-amine
CID 1989641
Isobutyl-(3-morpholin-4-yl-propyl)-amine
CID 3151942
1-(2-Propoxyethyl)piperazine
CID 2760475
2-(2,6-Dimethylmorpholin-4-yl)-2-methylpropan-1-amine
CID 16227393
3-Methyl-2-(morpholin-4-yl)butan-1-amine
CID 16227933
N,N-Dimethyl-3-morpholinemethanamine
CID 18915134
2-(3,3-Dimethylmorpholin-4-yl)ethan-1-amine
CID 50987580
rac-(2R,6S)-1-(2-methoxyethyl)-2,6-dimethylpiperazine
CID 51623023
1-(2-Methoxy-1,1-dimethylethyl)piperazine
CID 57420347
Methyl[2-methyl-1-(morpholin-4-yl)propan-2-yl]amine
CID 59535411
Methyl[1-(morpholin-4-yl)propan-2-yl]amine
CID 61501008

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine?
The IUPAC name of 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine (CID 116500776) is 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine.
What is the SMILES notation for 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine?
The canonical SMILES for 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine is COCC(C)CNCC(C)(C)N1CCOCC1.
What is the InChIKey of 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine?
The InChIKey is XSGUSYSTMBVMTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-12(10-16-4)9-14-11-13(2,3)15-5-7-17-8-6-15/h12,14H,5-11H2,1-4H3.
What are the key properties of 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine?
3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine has a molecular weight of 244.38 g/mol, XLogP of 0.97, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)propan-1-amine is sourced from PubChem (CID 116500776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).