1-(oxolan-2-yl)ethanamine;hydrochloride

C6H14ClNO — CID 75537284

IUPAC1-(oxolan-2-yl)ethanamine;hydrochloride
SMILESCC(N)C1CCCO1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-5(7)6-3-2-4-8-6;/h5-6H,2-4,7H2,1H3;1H
InChIKeyDFASQTDHYKLZCO-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.93
Rot. Bonds1

About 1-(oxolan-2-yl)ethanamine;hydrochloride

1-(oxolan-2-yl)ethanamine;hydrochloride (PubChem CID 75537284) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is 1-(oxolan-2-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name1-(oxolan-2-yl)ethanamine;hydrochloride
PubChem CID75537284
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name1-(oxolan-2-yl)ethanamine;hydrochloride
SMILESCC(N)C1CCCO1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-5(7)6-3-2-4-8-6;/h5-6H,2-4,7H2,1H3;1H
InChIKeyDFASQTDHYKLZCO-UHFFFAOYSA-N
XLogP0.93
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 ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yl)ethanamine;hydrochloride?
The IUPAC name of 1-(oxolan-2-yl)ethanamine;hydrochloride (CID 75537284) is 1-(oxolan-2-yl)ethanamine;hydrochloride.
What is the SMILES notation for 1-(oxolan-2-yl)ethanamine;hydrochloride?
The canonical SMILES for 1-(oxolan-2-yl)ethanamine;hydrochloride is CC(N)C1CCCO1.Cl.
What is the InChIKey of 1-(oxolan-2-yl)ethanamine;hydrochloride?
The InChIKey is DFASQTDHYKLZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-5(7)6-3-2-4-8-6;/h5-6H,2-4,7H2,1H3;1H.
What are the key properties of 1-(oxolan-2-yl)ethanamine;hydrochloride?
1-(oxolan-2-yl)ethanamine;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)ethanamine;hydrochloride is sourced from PubChem (CID 75537284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).