4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine

C8H10N4OS — CID 130497445

IUPAC4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine
SMILESCOc1cc(-c2csc(N)n2)nn1C
InChIInChI=1S/C8H10N4OS/c1-12-7(13-2)3-5(11-12)6-4-14-8(9)10-6/h3-4H,1-2H3,(H2,9,10)
InChIKeyYTTXBLQBJBKCBR-UHFFFAOYSA-N
MW210.26 g/mol
LogP1.13
Rot. Bonds2

About 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine

4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine (PubChem CID 130497445) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine
PubChem CID130497445
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine
SMILESCOc1cc(-c2csc(N)n2)nn1C
InChIInChI=1S/C8H10N4OS/c1-12-7(13-2)3-5(11-12)6-4-14-8(9)10-6/h3-4H,1-2H3,(H2,9,10)
InChIKeyYTTXBLQBJBKCBR-UHFFFAOYSA-N
XLogP1.13
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine (CID 130497445) is 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine is COc1cc(-c2csc(N)n2)nn1C.
What is the InChIKey of 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine?
The InChIKey is YTTXBLQBJBKCBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4OS/c1-12-7(13-2)3-5(11-12)6-4-14-8(9)10-6/h3-4H,1-2H3,(H2,9,10).
What are the key properties of 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine?
4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine has a molecular weight of 210.26 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methoxy-1-methylpyrazol-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 130497445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).