N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide

C14H13N3OS — CID 1484439

IUPACN,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide
SMILESCNC(=O)c1cc2c(-c3ccccc3)nn(C)c2s1
InChIInChI=1S/C14H13N3OS/c1-15-13(18)11-8-10-12(9-6-4-3-5-7-9)16-17(2)14(10)19-11/h3-8H,1-2H3,(H,15,18)
InChIKeyIZNYMWNGYYWXPI-UHFFFAOYSA-N
MW271.35 g/mol
LogP2.66
Rot. Bonds2

About N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide

N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide (PubChem CID 1484439) has the molecular formula C14H13N3OS and a molecular weight of 271.35 g/mol. Its IUPAC name is N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide
PubChem CID1484439
Molecular FormulaC14H13N3OS
Molecular Weight271.35 g/mol
Exact Mass271.08
IUPAC NameN,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide
SMILESCNC(=O)c1cc2c(-c3ccccc3)nn(C)c2s1
InChIInChI=1S/C14H13N3OS/c1-15-13(18)11-8-10-12(9-6-4-3-5-7-9)16-17(2)14(10)19-11/h3-8H,1-2H3,(H,15,18)
InChIKeyIZNYMWNGYYWXPI-UHFFFAOYSA-N
XLogP2.66
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,1-dimethyl-3-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

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide?
The IUPAC name of N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide (CID 1484439) is N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide.
What is the SMILES notation for N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide?
The canonical SMILES for N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide is CNC(=O)c1cc2c(-c3ccccc3)nn(C)c2s1.
What is the InChIKey of N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide?
The InChIKey is IZNYMWNGYYWXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c1-15-13(18)11-8-10-12(9-6-4-3-5-7-9)16-17(2)14(10)19-11/h3-8H,1-2H3,(H,15,18).
What are the key properties of N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide?
N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide has a molecular weight of 271.35 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-3-phenylthieno[3,2-d]pyrazole-5-carboxamide is sourced from PubChem (CID 1484439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).