5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride

C7H7ClN2OS — CID 122156681

IUPAC5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride
SMILESCl.Nc1cc(-c2cccs2)on1
InChIInChI=1S/C7H6N2OS.ClH/c8-7-4-5(10-9-7)6-2-1-3-11-6;/h1-4H,(H2,8,9);1H
InChIKeyNUMCMFIEIOFYFM-UHFFFAOYSA-N
MW202.67 g/mol
LogP2.41
Rot. Bonds1

About 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride

5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride (PubChem CID 122156681) has the molecular formula C7H7ClN2OS and a molecular weight of 202.67 g/mol. Its IUPAC name is 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride.

Molecular Properties

Compound Name5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride
PubChem CID122156681
Molecular FormulaC7H7ClN2OS
Molecular Weight202.67 g/mol
Exact Mass202.00
IUPAC Name5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride
SMILESCl.Nc1cc(-c2cccs2)on1
InChIInChI=1S/C7H6N2OS.ClH/c8-7-4-5(10-9-7)6-2-1-3-11-6;/h1-4H,(H2,8,9);1H
InChIKeyNUMCMFIEIOFYFM-UHFFFAOYSA-N
XLogP2.41
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.67
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride?
The IUPAC name of 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride (CID 122156681) is 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride.
What is the SMILES notation for 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride?
The canonical SMILES for 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride is Cl.Nc1cc(-c2cccs2)on1.
What is the InChIKey of 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride?
The InChIKey is NUMCMFIEIOFYFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2OS.ClH/c8-7-4-5(10-9-7)6-2-1-3-11-6;/h1-4H,(H2,8,9);1H.
What are the key properties of 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride?
5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride has a molecular weight of 202.67 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-yl-1,2-oxazol-3-amine;hydrochloride is sourced from PubChem (CID 122156681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).