1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride

C8H14ClN3O — CID 119032067

IUPAC1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride
SMILESCc1nc(C(C)(N)C2CC2)no1.Cl
InChIInChI=1S/C8H13N3O.ClH/c1-5-10-7(11-12-5)8(2,9)6-3-4-6;/h6H,3-4,9H2,1-2H3;1H
InChIKeyQSECVQRQNNLZHB-UHFFFAOYSA-N
MW203.67 g/mol
LogP1.38
Rot. Bonds2

About 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride

1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride (PubChem CID 119032067) has the molecular formula C8H14ClN3O and a molecular weight of 203.67 g/mol. Its IUPAC name is 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride
PubChem CID119032067
Molecular FormulaC8H14ClN3O
Molecular Weight203.67 g/mol
Exact Mass203.08
IUPAC Name1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride
SMILESCc1nc(C(C)(N)C2CC2)no1.Cl
InChIInChI=1S/C8H13N3O.ClH/c1-5-10-7(11-12-5)8(2,9)6-3-4-6;/h6H,3-4,9H2,1-2H3;1H
InChIKeyQSECVQRQNNLZHB-UHFFFAOYSA-N
XLogP1.38
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.67
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride?
The IUPAC name of 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride (CID 119032067) is 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride.
What is the SMILES notation for 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride?
The canonical SMILES for 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride is Cc1nc(C(C)(N)C2CC2)no1.Cl.
What is the InChIKey of 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride?
The InChIKey is QSECVQRQNNLZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O.ClH/c1-5-10-7(11-12-5)8(2,9)6-3-4-6;/h6H,3-4,9H2,1-2H3;1H.
What are the key properties of 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride?
1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride has a molecular weight of 203.67 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride is sourced from PubChem (CID 119032067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).