2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine

C7H16N2O — CID 142994239

IUPAC2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine
SMILESNCC[C@H]1CC[C@@H](CN)O1
InChIInChI=1S/C7H16N2O/c8-4-3-6-1-2-7(5-9)10-6/h6-7H,1-5,8-9H2/t6-,7+/m1/s1
InChIKeyQTWISUWRVURBJY-RQJHMYQMSA-N
MW144.22 g/mol
LogP-0.16
Rot. Bonds3

About 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine

2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine (PubChem CID 142994239) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine.

Molecular Properties

Compound Name2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine
PubChem CID142994239
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine
SMILESNCC[C@H]1CC[C@@H](CN)O1
InChIInChI=1S/C7H16N2O/c8-4-3-6-1-2-7(5-9)10-6/h6-7H,1-5,8-9H2/t6-,7+/m1/s1
InChIKeyQTWISUWRVURBJY-RQJHMYQMSA-N
XLogP-0.16
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(2-aminoethyl)oxolan-2-yl]ethylazanium
CID 148500686
2-[5-(2-methylpropyl)oxolan-2-yl]ethanamine
CID 130464376
2-[5-(5-methyloxolan-2-yl)oxolan-2-yl]ethanamine
CID 130585766
[(2R,5R)-5-methyloxolan-2-yl]methanamine
CID 124512926
[5-(2-pyridin-4-ylethyl)oxolan-2-yl]methanamine
CID 59825607
[(2R,5S)-5-cyclopropyloxolan-2-yl]methanamine
CID 155905472
ethane-1,2-diamine;[5-(hydroxymethyl)oxolan-2-yl]methanol
CID 174792194
N-[[(2S,5R)-5-(aminomethyl)oxolan-2-yl]methyl]-N-methylpropan-2-amine
CID 94435022
[5-(propoxymethyl)oxolan-2-yl]methanamine
CID 62451334
[5-[(2,3,5-trimethylpiperidin-1-yl)methyl]oxolan-2-yl]methanamine
CID 114593786
N-[[5-(aminomethyl)oxolan-2-yl]methyl]-N-methylbutan-2-amine
CID 62419353
2-[(2R,5S)-5-[2-(5-fluoro-2-methoxyphenyl)ethyl]oxolan-2-yl]ethanamine
CID 44590694

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine?
The IUPAC name of 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine (CID 142994239) is 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine.
What is the SMILES notation for 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine?
The canonical SMILES for 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine is NCC[C@H]1CC[C@@H](CN)O1.
What is the InChIKey of 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine?
The InChIKey is QTWISUWRVURBJY-RQJHMYQMSA-N. The full InChI is InChI=1S/C7H16N2O/c8-4-3-6-1-2-7(5-9)10-6/h6-7H,1-5,8-9H2/t6-,7+/m1/s1.
What are the key properties of 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine?
2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine has a molecular weight of 144.22 g/mol, XLogP of -0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,5S)-5-(aminomethyl)oxolan-2-yl]ethanamine is sourced from PubChem (CID 142994239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).