2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide

C10H15N3OS — CID 127254459

IUPAC2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide
SMILESCC(C)C(=O)Nc1c2c(nn1C)CSC2
InChIInChI=1S/C10H15N3OS/c1-6(2)10(14)11-9-7-4-15-5-8(7)12-13(9)3/h6H,4-5H2,1-3H3,(H,11,14)
InChIKeyWFMWBNWEEDRUFE-UHFFFAOYSA-N
MW225.32 g/mol
LogP1.76
Rot. Bonds2

About 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide

2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide (PubChem CID 127254459) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide
PubChem CID127254459
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide
SMILESCC(C)C(=O)Nc1c2c(nn1C)CSC2
InChIInChI=1S/C10H15N3OS/c1-6(2)10(14)11-9-7-4-15-5-8(7)12-13(9)3/h6H,4-5H2,1-3H3,(H,11,14)
InChIKeyWFMWBNWEEDRUFE-UHFFFAOYSA-N
XLogP1.76
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide?
The IUPAC name of 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide (CID 127254459) is 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide?
The canonical SMILES for 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide is CC(C)C(=O)Nc1c2c(nn1C)CSC2.
What is the InChIKey of 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide?
The InChIKey is WFMWBNWEEDRUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-6(2)10(14)11-9-7-4-15-5-8(7)12-13(9)3/h6H,4-5H2,1-3H3,(H,11,14).
What are the key properties of 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide?
2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide has a molecular weight of 225.32 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)propanamide is sourced from PubChem (CID 127254459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).