N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide

C11H14N4O2S — CID 136518419

IUPACN,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide
SMILESCN(C)C(=O)C1CSCN1C(=O)c1ccnnc1
InChIInChI=1S/C11H14N4O2S/c1-14(2)11(17)9-6-18-7-15(9)10(16)8-3-4-12-13-5-8/h3-5,9H,6-7H2,1-2H3
InChIKeyWCVAVDUYNHZWGR-UHFFFAOYSA-N
MW266.33 g/mol
LogP0.08
Rot. Bonds2

About N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide

N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 136518419) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide
PubChem CID136518419
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC NameN,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide
SMILESCN(C)C(=O)C1CSCN1C(=O)c1ccnnc1
InChIInChI=1S/C11H14N4O2S/c1-14(2)11(17)9-6-18-7-15(9)10(16)8-3-4-12-13-5-8/h3-5,9H,6-7H2,1-2H3
InChIKeyWCVAVDUYNHZWGR-UHFFFAOYSA-N
XLogP0.08
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 50.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide (CID 136518419) is N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide is CN(C)C(=O)C1CSCN1C(=O)c1ccnnc1.
What is the InChIKey of N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is WCVAVDUYNHZWGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-14(2)11(17)9-6-18-7-15(9)10(16)8-3-4-12-13-5-8/h3-5,9H,6-7H2,1-2H3.
What are the key properties of N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide?
N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 266.33 g/mol, XLogP of 0.08, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(pyridazine-4-carbonyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 136518419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).