4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine

C11H15N3OS — CID 81121896

IUPAC4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine
SMILESCCc1c(-c2sccc2OC)nn(C)c1N
InChIInChI=1S/C11H15N3OS/c1-4-7-9(13-14(2)11(7)12)10-8(15-3)5-6-16-10/h5-6H,4,12H2,1-3H3
InChIKeyZUQFRZXOTNKISO-UHFFFAOYSA-N
MW237.33 g/mol
LogP2.30
Rot. Bonds3

About 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine

4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine (PubChem CID 81121896) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine
PubChem CID81121896
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC Name4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine
SMILESCCc1c(-c2sccc2OC)nn(C)c1N
InChIInChI=1S/C11H15N3OS/c1-4-7-9(13-14(2)11(7)12)10-8(15-3)5-6-16-10/h5-6H,4,12H2,1-3H3
InChIKeyZUQFRZXOTNKISO-UHFFFAOYSA-N
XLogP2.30
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine (CID 81121896) is 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine is CCc1c(-c2sccc2OC)nn(C)c1N.
What is the InChIKey of 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine?
The InChIKey is ZUQFRZXOTNKISO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c1-4-7-9(13-14(2)11(7)12)10-8(15-3)5-6-16-10/h5-6H,4,12H2,1-3H3.
What are the key properties of 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine?
4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine has a molecular weight of 237.33 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-(3-methoxythiophen-2-yl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 81121896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).