2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride

C7H13ClN2O — CID 66588553

IUPAC2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
SMILESCCc1cnc(CCN)o1.Cl
InChIInChI=1S/C7H12N2O.ClH/c1-2-6-5-9-7(10-6)3-4-8;/h5H,2-4,8H2,1H3;1H
InChIKeyRFVMFEVRMBBYJS-UHFFFAOYSA-N
MW176.65 g/mol
LogP1.16
Rot. Bonds3

About 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride

2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride (PubChem CID 66588553) has the molecular formula C7H13ClN2O and a molecular weight of 176.65 g/mol. Its IUPAC name is 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
PubChem CID66588553
Molecular FormulaC7H13ClN2O
Molecular Weight176.65 g/mol
Exact Mass176.07
IUPAC Name2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
SMILESCCc1cnc(CCN)o1.Cl
InChIInChI=1S/C7H12N2O.ClH/c1-2-6-5-9-7(10-6)3-4-8;/h5H,2-4,8H2,1H3;1H
InChIKeyRFVMFEVRMBBYJS-UHFFFAOYSA-N
XLogP1.16
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.65
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride?
The IUPAC name of 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride (CID 66588553) is 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride?
The canonical SMILES for 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride is CCc1cnc(CCN)o1.Cl.
What is the InChIKey of 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride?
The InChIKey is RFVMFEVRMBBYJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O.ClH/c1-2-6-5-9-7(10-6)3-4-8;/h5H,2-4,8H2,1H3;1H.
What are the key properties of 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride?
2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride has a molecular weight of 176.65 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride is sourced from PubChem (CID 66588553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).