1-(oxolan-3-yl)ethanamine;hydrochloride

C6H14ClNO — CID 91662865

IUPAC1-(oxolan-3-yl)ethanamine;hydrochloride
SMILESCC(N)C1CCOC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-5(7)6-2-3-8-4-6;/h5-6H,2-4,7H2,1H3;1H
InChIKeyZYZOZVDOIHZJFI-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.79
Rot. Bonds1

About 1-(oxolan-3-yl)ethanamine;hydrochloride

1-(oxolan-3-yl)ethanamine;hydrochloride (PubChem CID 91662865) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is 1-(oxolan-3-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name1-(oxolan-3-yl)ethanamine;hydrochloride
PubChem CID91662865
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name1-(oxolan-3-yl)ethanamine;hydrochloride
SMILESCC(N)C1CCOC1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-5(7)6-2-3-8-4-6;/h5-6H,2-4,7H2,1H3;1H
InChIKeyZYZOZVDOIHZJFI-UHFFFAOYSA-N
XLogP0.79
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.64
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(Oxolan-3-yl)methanamine hydrochloride
CID 17750392
1-(Oxolan-3-yl)ethan-1-amine
CID 21054629
1-(Oxan-4-yl)ethan-1-amine
CID 21054631
1-(Oxolan-3-yl)propan-1-amine
CID 54595718
3-Oxabicyclo[3.1.0]hexan-6-amine hydrochloride
CID 57452014
(R)-1-(Tetrahydro-2H-pyran-4-YL)ethanamine
CID 58368062
(S)-1-(Tetrahydro-2H-pyran-4-YL)ethanamine
CID 67033300
(1R)-1-(oxan-4-yl)ethan-1-amine hydrochloride
CID 67034028
(1S)-1-(oxan-4-yl)ethan-1-amine hydrochloride
CID 67034328
1-((3R)-oxolan-3-yl)methanamine hydrochloride
CID 71742660
(S)-(Tetrahydrofuran-3-yl)methanamine hydrochloride
CID 71742661
(1R,5S,6R)-3-oxabicyclo[3.1.0]hexan-6-amine hydrochloride
CID 91647632

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-yl)ethanamine;hydrochloride?
The IUPAC name of 1-(oxolan-3-yl)ethanamine;hydrochloride (CID 91662865) is 1-(oxolan-3-yl)ethanamine;hydrochloride.
What is the SMILES notation for 1-(oxolan-3-yl)ethanamine;hydrochloride?
The canonical SMILES for 1-(oxolan-3-yl)ethanamine;hydrochloride is CC(N)C1CCOC1.Cl.
What is the InChIKey of 1-(oxolan-3-yl)ethanamine;hydrochloride?
The InChIKey is ZYZOZVDOIHZJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-5(7)6-2-3-8-4-6;/h5-6H,2-4,7H2,1H3;1H.
What are the key properties of 1-(oxolan-3-yl)ethanamine;hydrochloride?
1-(oxolan-3-yl)ethanamine;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-yl)ethanamine;hydrochloride is sourced from PubChem (CID 91662865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).