2,5-dimethyloxolan-3-amine;hydrochloride

C6H14ClNO — CID 118271854

IUPAC2,5-dimethyloxolan-3-amine;hydrochloride
SMILESCC1CC(N)C(C)O1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-4-3-6(7)5(2)8-4;/h4-6H,3,7H2,1-2H3;1H
InChIKeyMMOXFJHAKXSCGU-UHFFFAOYSA-N
MW151.64 g/mol
LogP0.93
Rot. Bonds

About 2,5-dimethyloxolan-3-amine;hydrochloride

2,5-dimethyloxolan-3-amine;hydrochloride (PubChem CID 118271854) has the molecular formula C6H14ClNO and a molecular weight of 151.64 g/mol. Its IUPAC name is 2,5-dimethyloxolan-3-amine;hydrochloride.

Molecular Properties

Compound Name2,5-dimethyloxolan-3-amine;hydrochloride
PubChem CID118271854
Molecular FormulaC6H14ClNO
Molecular Weight151.64 g/mol
Exact Mass151.08
IUPAC Name2,5-dimethyloxolan-3-amine;hydrochloride
SMILESCC1CC(N)C(C)O1.Cl
InChIInChI=1S/C6H13NO.ClH/c1-4-3-6(7)5(2)8-4;/h4-6H,3,7H2,1-2H3;1H
InChIKeyMMOXFJHAKXSCGU-UHFFFAOYSA-N
XLogP0.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
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 2,5-dimethyloxolan-3-amine;hydrochloride?
The IUPAC name of 2,5-dimethyloxolan-3-amine;hydrochloride (CID 118271854) is 2,5-dimethyloxolan-3-amine;hydrochloride.
What is the SMILES notation for 2,5-dimethyloxolan-3-amine;hydrochloride?
The canonical SMILES for 2,5-dimethyloxolan-3-amine;hydrochloride is CC1CC(N)C(C)O1.Cl.
What is the InChIKey of 2,5-dimethyloxolan-3-amine;hydrochloride?
The InChIKey is MMOXFJHAKXSCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.ClH/c1-4-3-6(7)5(2)8-4;/h4-6H,3,7H2,1-2H3;1H.
What are the key properties of 2,5-dimethyloxolan-3-amine;hydrochloride?
2,5-dimethyloxolan-3-amine;hydrochloride has a molecular weight of 151.64 g/mol, XLogP of 0.93, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyloxolan-3-amine;hydrochloride is sourced from PubChem (CID 118271854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).