N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide

C15H19N3OS2 — CID 3677366

IUPACN-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide
SMILESCC(C)(C)n1nc2c(c1NC(=O)Cc1cccs1)CSC2
InChIInChI=1S/C15H19N3OS2/c1-15(2,3)18-14(11-8-20-9-12(11)17-18)16-13(19)7-10-5-4-6-21-10/h4-6H,7-9H2,1-3H3,(H,16,19)
InChIKeySDBVEYNEOOLCOL-UHFFFAOYSA-N
MW321.47 g/mol
LogP3.63
Rot. Bonds3

About N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide

N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide (PubChem CID 3677366) has the molecular formula C15H19N3OS2 and a molecular weight of 321.47 g/mol. Its IUPAC name is N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide
PubChem CID3677366
Molecular FormulaC15H19N3OS2
Molecular Weight321.47 g/mol
Exact Mass321.10
IUPAC NameN-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide
SMILESCC(C)(C)n1nc2c(c1NC(=O)Cc1cccs1)CSC2
InChIInChI=1S/C15H19N3OS2/c1-15(2,3)18-14(11-8-20-9-12(11)17-18)16-13(19)7-10-5-4-6-21-10/h4-6H,7-9H2,1-3H3,(H,16,19)
InChIKeySDBVEYNEOOLCOL-UHFFFAOYSA-N
XLogP3.63
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.47
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(4-methylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]thiophene-2-carboxamide
CID 3235680
N-(2-(tert-butyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-(4-fluorophenyl)acetamide
CID 3311904
N-(2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophenecarboxamide
CID 756307
N-(2-phenyl-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)butyramide
CID 3567868
N-(2-(4-fluorophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)thiophene-2-carboxamide
CID 4382339
N-(2-(4-fluorophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-(thiophen-2-yl)acetamide
CID 3276415
N-(5,5-dioxido-2-phenyl-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)thiophene-2-carboxamide
CID 4413719
N-(2-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)thiophene-2-carboxamide
CID 30859087
N-(2,5-dimethylpyrazol-3-yl)-3-thiophen-3-ylpropanamide
CID 45811643
(E)-N-(2-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-3-(thiophen-2-yl)acrylamide
CID 30859099
N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-3-phenylpropanamide
CID 4159767
N-[2-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]thiophene-2-carboxamide
CID 135551577

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide (CID 3677366) is N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide is CC(C)(C)n1nc2c(c1NC(=O)Cc1cccs1)CSC2.
What is the InChIKey of N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide?
The InChIKey is SDBVEYNEOOLCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS2/c1-15(2,3)18-14(11-8-20-9-12(11)17-18)16-13(19)7-10-5-4-6-21-10/h4-6H,7-9H2,1-3H3,(H,16,19).
What are the key properties of N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide?
N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide has a molecular weight of 321.47 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 3677366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).