6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine

C11H14ClN5O2 — CID 71980285

IUPAC6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine
SMILESCOC(C)c1noc(CN(C)c2cncc(Cl)n2)n1
InChIInChI=1S/C11H14ClN5O2/c1-7(18-3)11-15-10(19-16-11)6-17(2)9-5-13-4-8(12)14-9/h4-5,7H,6H2,1-3H3
InChIKeyAYULRCFZXJPEGI-UHFFFAOYSA-N
MW283.72 g/mol
LogP1.86
Rot. Bonds5

About 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine

6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine (PubChem CID 71980285) has the molecular formula C11H14ClN5O2 and a molecular weight of 283.72 g/mol. Its IUPAC name is 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine
PubChem CID71980285
Molecular FormulaC11H14ClN5O2
Molecular Weight283.72 g/mol
Exact Mass283.08
IUPAC Name6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine
SMILESCOC(C)c1noc(CN(C)c2cncc(Cl)n2)n1
InChIInChI=1S/C11H14ClN5O2/c1-7(18-3)11-15-10(19-16-11)6-17(2)9-5-13-4-8(12)14-9/h4-5,7H,6H2,1-3H3
InChIKeyAYULRCFZXJPEGI-UHFFFAOYSA-N
XLogP1.86
TPSA77.17 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.72
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine?
The IUPAC name of 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine (CID 71980285) is 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine?
The canonical SMILES for 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine is COC(C)c1noc(CN(C)c2cncc(Cl)n2)n1.
What is the InChIKey of 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine?
The InChIKey is AYULRCFZXJPEGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN5O2/c1-7(18-3)11-15-10(19-16-11)6-17(2)9-5-13-4-8(12)14-9/h4-5,7H,6H2,1-3H3.
What are the key properties of 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine?
6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine has a molecular weight of 283.72 g/mol, XLogP of 1.86, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[[3-(1-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpyrazin-2-amine is sourced from PubChem (CID 71980285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).