N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine

C11H23NO2 — CID 102606083

IUPACN-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine
SMILESCCNC(COC1COC1)C(C)CC
InChIInChI=1S/C11H23NO2/c1-4-9(3)11(12-5-2)8-14-10-6-13-7-10/h9-12H,4-8H2,1-3H3
InChIKeyQHMUEMOEWIAAPQ-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.43
Rot. Bonds7

About N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine

N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine (PubChem CID 102606083) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine
PubChem CID102606083
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine
SMILESCCNC(COC1COC1)C(C)CC
InChIInChI=1S/C11H23NO2/c1-4-9(3)11(12-5-2)8-14-10-6-13-7-10/h9-12H,4-8H2,1-3H3
InChIKeyQHMUEMOEWIAAPQ-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
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

1-cyclopentyl-N-ethyl-2-(oxetan-3-yloxy)ethanamine
CID 102605900
(2R)-1-(oxetan-3-yloxy)butan-2-ol
CID 124603359
(2S)-1-(oxetan-3-yloxy)butan-2-ol
CID 124603358
N-ethyl-2,5-dimethylheptan-4-amine
CID 63717421
1-(4-ethoxyphenyl)-N-ethyl-2-(oxetan-3-yloxy)ethanamine
CID 102606061
N-ethyl-1-(2-fluorophenyl)-2-(oxetan-3-yloxy)ethanamine
CID 114058381
N-ethyl-2-(oxetan-3-ylsulfanyl)pentan-3-amine
CID 79333580
2-N-ethyl-3-methylpentane-1,2-diamine
CID 62066397
N-ethyl-3,3-dimethyl-1-(oxolan-3-yloxy)butan-2-amine
CID 63558838
N-ethyl-3,6-dimethyloctan-4-amine
CID 63717606
1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine
CID 103487691
N-ethyl-1-(2-methoxy-5-methylphenyl)-2-(oxetan-3-yloxy)ethanamine
CID 102606127

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine?
The IUPAC name of N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine (CID 102606083) is N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine.
What is the SMILES notation for N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine?
The canonical SMILES for N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine is CCNC(COC1COC1)C(C)CC.
What is the InChIKey of N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine?
The InChIKey is QHMUEMOEWIAAPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-4-9(3)11(12-5-2)8-14-10-6-13-7-10/h9-12H,4-8H2,1-3H3.
What are the key properties of N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine?
N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine has a molecular weight of 201.31 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-1-(oxetan-3-yloxy)pentan-2-amine is sourced from PubChem (CID 102606083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).