N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine

C11H21NO2 — CID 82837371

IUPACN-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine
SMILESCCNCC1CCOC1C1CCCO1
InChIInChI=1S/C11H21NO2/c1-2-12-8-9-5-7-14-11(9)10-4-3-6-13-10/h9-12H,2-8H2,1H3
InChIKeyMIUKPWBUVGUSMY-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.18
Rot. Bonds4

About N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine

N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine (PubChem CID 82837371) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine
PubChem CID82837371
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine
SMILESCCNCC1CCOC1C1CCCO1
InChIInChI=1S/C11H21NO2/c1-2-12-8-9-5-7-14-11(9)10-4-3-6-13-10/h9-12H,2-8H2,1H3
InChIKeyMIUKPWBUVGUSMY-UHFFFAOYSA-N
XLogP1.18
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(4-methylcyclohexyl)oxan-3-yl]methyl]ethanamine
CID 79364991
[2-(oxolan-2-yl)oxolan-3-yl]methanamine
CID 82837467
N-[(2-cyclooctyloxolan-3-yl)methyl]propan-1-amine
CID 114207979
N-(oxetan-2-ylmethyl)ethanamine
CID 89405664
N-[[2-(4-tert-butylphenyl)oxolan-3-yl]methyl]ethanamine
CID 79368719
(3aR,6S,6aR)-6-ethyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 167164363
1-(2-cyclopropyloxan-3-yl)-N-methylmethanamine
CID 79365541
N-[[2-(4-methylsulfanylphenyl)oxolan-3-yl]methyl]ethanamine
CID 79368622
N-[[2-(2-methylphenyl)oxan-3-yl]methyl]ethanamine
CID 79364725
N-[(2-cycloheptyloxan-3-yl)methyl]-2-methylpropan-1-amine
CID 79364575
N-[[2-(3-bromophenyl)oxolan-3-yl]methyl]ethanamine
CID 79368720
N-[[2-(2-methylphenyl)oxolan-3-yl]methyl]ethanamine
CID 79368429

Frequently Asked Questions

What is the IUPAC name of N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine (CID 82837371) is N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine is CCNCC1CCOC1C1CCCO1.
What is the InChIKey of N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine?
The InChIKey is MIUKPWBUVGUSMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-2-12-8-9-5-7-14-11(9)10-4-3-6-13-10/h9-12H,2-8H2,1H3.
What are the key properties of N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine?
N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine has a molecular weight of 199.29 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(oxolan-2-yl)oxolan-3-yl]methyl]ethanamine is sourced from PubChem (CID 82837371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).