3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine

C11H23NO2 — CID 103027188

IUPAC3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine
SMILESCNC(CC(C)(C)OC)C1CCOC1
InChIInChI=1S/C11H23NO2/c1-11(2,13-4)7-10(12-3)9-5-6-14-8-9/h9-10,12H,5-8H2,1-4H3
InChIKeyMBRYWLFHAIYIIC-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.43
Rot. Bonds5

About 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine

3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine (PubChem CID 103027188) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine.

Molecular Properties

Compound Name3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine
PubChem CID103027188
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine
SMILESCNC(CC(C)(C)OC)C1CCOC1
InChIInChI=1S/C11H23NO2/c1-11(2,13-4)7-10(12-3)9-5-6-14-8-9/h9-10,12H,5-8H2,1-4H3
InChIKeyMBRYWLFHAIYIIC-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-N,3-dimethyl-1-(oxan-4-yl)butan-1-amine
CID 103027181
N-ethyl-3-methoxy-3-methyl-1-(oxan-4-yl)butan-1-amine
CID 103027183
3-Methoxy-3-methyl-1-(oxolan-3-yl)butan-1-amine
CID 103027189
N-ethyl-3-methoxy-3-methyl-1-(oxolan-3-yl)butan-1-amine
CID 103027190
3-methoxy-3-methyl-1-(oxolan-3-yl)-N-propylbutan-1-amine
CID 103027191
5-methoxy-N,5-dimethyl-1-(oxolan-2-yl)hexan-3-amine
CID 103027358
1,6-dimethoxy-N,3,6-trimethylheptan-4-amine
CID 103029405
N-ethyl-1,6-dimethoxy-3,6-dimethylheptan-4-amine
CID 103029407
1,6-dimethoxy-3,6-dimethyl-N-propylheptan-4-amine
CID 103029408
3-methoxy-N,3-dimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-amine
CID 103029490
3-Methoxy-3-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-amine
CID 103029491
N-ethyl-3-methoxy-3-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-amine
CID 103029492

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine?
The IUPAC name of 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine (CID 103027188) is 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine.
What is the SMILES notation for 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine?
The canonical SMILES for 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine is CNC(CC(C)(C)OC)C1CCOC1.
What is the InChIKey of 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine?
The InChIKey is MBRYWLFHAIYIIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-11(2,13-4)7-10(12-3)9-5-6-14-8-9/h9-10,12H,5-8H2,1-4H3.
What are the key properties of 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine?
3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine has a molecular weight of 201.31 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N,3-dimethyl-1-(oxolan-3-yl)butan-1-amine is sourced from PubChem (CID 103027188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).