4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide

C11H14N4OS — CID 61090609

IUPAC4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide
SMILESCc1cc(NC(=O)c2cc(N)c(C)s2)n(C)n1
InChIInChI=1S/C11H14N4OS/c1-6-4-10(15(3)14-6)13-11(16)9-5-8(12)7(2)17-9/h4-5H,12H2,1-3H3,(H,13,16)
InChIKeyRICDEMYUKYYZGB-UHFFFAOYSA-N
MW250.33 g/mol
LogP1.93
Rot. Bonds2

About 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide

4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide (PubChem CID 61090609) has the molecular formula C11H14N4OS and a molecular weight of 250.33 g/mol. Its IUPAC name is 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide
PubChem CID61090609
Molecular FormulaC11H14N4OS
Molecular Weight250.33 g/mol
Exact Mass250.09
IUPAC Name4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide
SMILESCc1cc(NC(=O)c2cc(N)c(C)s2)n(C)n1
InChIInChI=1S/C11H14N4OS/c1-6-4-10(15(3)14-6)13-11(16)9-5-8(12)7(2)17-9/h4-5H,12H2,1-3H3,(H,13,16)
InChIKeyRICDEMYUKYYZGB-UHFFFAOYSA-N
XLogP1.93
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide?
The IUPAC name of 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide (CID 61090609) is 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide?
The canonical SMILES for 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide is Cc1cc(NC(=O)c2cc(N)c(C)s2)n(C)n1.
What is the InChIKey of 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide?
The InChIKey is RICDEMYUKYYZGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4OS/c1-6-4-10(15(3)14-6)13-11(16)9-5-8(12)7(2)17-9/h4-5H,12H2,1-3H3,(H,13,16).
What are the key properties of 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide?
4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide has a molecular weight of 250.33 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,5-dimethylpyrazol-3-yl)-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 61090609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).