N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide

C19H19N5O3S — CID 66819296

IUPACN-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
SMILESCc1nn(-c2ccccc2)c2sc(C(=O)N[C@H](C)CN3C(=O)CNC3=O)cc12
InChIInChI=1S/C19H19N5O3S/c1-11(10-23-16(25)9-20-19(23)27)21-17(26)15-8-14-12(2)22-24(18(14)28-15)13-6-4-3-5-7-13/h3-8,11H,9-10H2,1-2H3,(H,20,27)(H,21,26)/t11-/m1/s1
InChIKeySCBDETQXSJAKFK-LLVKDONJSA-N
MW397.46 g/mol
LogP2.07
Rot. Bonds5

About N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide

N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide (PubChem CID 66819296) has the molecular formula C19H19N5O3S and a molecular weight of 397.46 g/mol. Its IUPAC name is N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
PubChem CID66819296
Molecular FormulaC19H19N5O3S
Molecular Weight397.46 g/mol
Exact Mass397.12
IUPAC NameN-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
SMILESCc1nn(-c2ccccc2)c2sc(C(=O)N[C@H](C)CN3C(=O)CNC3=O)cc12
InChIInChI=1S/C19H19N5O3S/c1-11(10-23-16(25)9-20-19(23)27)21-17(26)15-8-14-12(2)22-24(18(14)28-15)13-6-4-3-5-7-13/h3-8,11H,9-10H2,1-2H3,(H,20,27)(H,21,26)/t11-/m1/s1
InChIKeySCBDETQXSJAKFK-LLVKDONJSA-N
XLogP2.07
TPSA96.33 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.46
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide 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

3-methyl-1-phenyl-N-[(1R)-1-phenylethyl]thieno[3,2-d]pyrazole-5-carboxamide
CID 29096780
3-methyl-1-phenyl-N-[(1S)-1-phenylethyl]thieno[3,2-d]pyrazole-5-carboxamide
CID 29096781
3-methyl-1-phenyl-N-[(2S)-1-(1,3,5-trimethylpyrazol-4-yl)propan-2-yl]thieno[3,2-d]pyrazole-5-carboxamide
CID 99811426
N-[3-(butan-2-ylamino)-3-oxopropyl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
CID 55948416
methyl (2R)-3-methyl-2-[(3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carbonyl)amino]butanoate
CID 2520796
3-methyl-N'-(3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carbonyl)-1-phenylthieno[3,2-d]pyrazole-5-carbohydrazide
CID 3226614
N-[(1R)-1-(2-ethylpyrazol-3-yl)ethyl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
CID 29096960
1-(4-chlorophenyl)-3-methyl-N-pentan-2-ylthieno[3,2-d]pyrazole-5-carboxamide
CID 3971166
1-cyclohexyl-N-[3-(2,5-dioxoimidazolidin-1-yl)-2,2-dimethylpropyl]-3-methylthieno[3,2-d]pyrazole-5-carboxamide;1-cyclohexyl-N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methylthieno[3,2-d]pyrazole-5-carboxamide
CID 160820136
N-(2-amino-2-methylpropyl)-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide
CID 119626981
1-(4-fluorophenyl)-3-methyl-N-[(1R)-1-phenylethyl]thieno[3,2-d]pyrazole-5-carboxamide
CID 95053217
N-[(2S)-1-aminopropan-2-yl]-1-(3-chlorophenyl)-3-methylthieno[3,2-d]pyrazole-5-carboxamide
CID 120508597

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide?
The IUPAC name of N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide (CID 66819296) is N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide.
What is the SMILES notation for N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide?
The canonical SMILES for N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide is Cc1nn(-c2ccccc2)c2sc(C(=O)N[C@H](C)CN3C(=O)CNC3=O)cc12.
What is the InChIKey of N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide?
The InChIKey is SCBDETQXSJAKFK-LLVKDONJSA-N. The full InChI is InChI=1S/C19H19N5O3S/c1-11(10-23-16(25)9-20-19(23)27)21-17(26)15-8-14-12(2)22-24(18(14)28-15)13-6-4-3-5-7-13/h3-8,11H,9-10H2,1-2H3,(H,20,27)(H,21,26)/t11-/m1/s1.
What are the key properties of N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide?
N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide has a molecular weight of 397.46 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(2,5-dioxoimidazolidin-1-yl)propan-2-yl]-3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carboxamide is sourced from PubChem (CID 66819296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).