2-amino-2-(oxolan-2-yl)ethanol;hydrochloride

C6H14ClNO2 — CID 69084455

IUPAC2-amino-2-(oxolan-2-yl)ethanol;hydrochloride
SMILESCl.NC(CO)C1CCCO1
InChIInChI=1S/C6H13NO2.ClH/c7-5(4-8)6-2-1-3-9-6;/h5-6,8H,1-4,7H2;1H
InChIKeyIGWFRSXECLKCOU-UHFFFAOYSA-N
MW167.64 g/mol
LogP-0.09
Rot. Bonds2

About 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride

2-amino-2-(oxolan-2-yl)ethanol;hydrochloride (PubChem CID 69084455) has the molecular formula C6H14ClNO2 and a molecular weight of 167.64 g/mol. Its IUPAC name is 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride.

Molecular Properties

Compound Name2-amino-2-(oxolan-2-yl)ethanol;hydrochloride
PubChem CID69084455
Molecular FormulaC6H14ClNO2
Molecular Weight167.64 g/mol
Exact Mass167.07
IUPAC Name2-amino-2-(oxolan-2-yl)ethanol;hydrochloride
SMILESCl.NC(CO)C1CCCO1
InChIInChI=1S/C6H13NO2.ClH/c7-5(4-8)6-2-1-3-9-6;/h5-6,8H,1-4,7H2;1H
InChIKeyIGWFRSXECLKCOU-UHFFFAOYSA-N
XLogP-0.09
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.64
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-3-[(2R)-oxan-2-yl]propan-1-ol;hydrochloride
CID 176655691
(2S)-2-[(2R)-oxan-2-yl]propan-1-ol
CID 102227489
1-(oxolan-2-yl)propane-1,3-diol
CID 119055061
(2R)-2-[(2R)-oxan-2-yl]propan-1-ol
CID 124662505
2-(2,2-difluoro-1-methylcyclopropyl)-1-(oxolan-2-yl)ethanamine
CID 164659616
2-(ethylamino)-2-(oxolan-2-yl)ethanol
CID 82838374
2-amino-4-methyl-1-(oxolan-2-yl)pentan-1-ol
CID 82837323
1,3-bis(oxan-2-yl)propan-1-amine
CID 173130870
(S)-cyclobutyl-[(2S)-oxolan-2-yl]methanamine
CID 124596085
(1S)-1-(oxolan-2-yl)propan-1-ol
CID 67355523
(1R)-1-[(2S)-oxolan-2-yl]propan-1-ol
CID 67355521
[2-hydroxy-1-(oxolan-2-yl)ethyl] acetate
CID 121404223

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride?
The IUPAC name of 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride (CID 69084455) is 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride.
What is the SMILES notation for 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride?
The canonical SMILES for 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride is Cl.NC(CO)C1CCCO1.
What is the InChIKey of 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride?
The InChIKey is IGWFRSXECLKCOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2.ClH/c7-5(4-8)6-2-1-3-9-6;/h5-6,8H,1-4,7H2;1H.
What are the key properties of 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride?
2-amino-2-(oxolan-2-yl)ethanol;hydrochloride has a molecular weight of 167.64 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(oxolan-2-yl)ethanol;hydrochloride is sourced from PubChem (CID 69084455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).