N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide

C9H11N3OS — CID 24692510

IUPACN-pyridin-4-yl-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1ccncc1)C1CSCN1
InChIInChI=1S/C9H11N3OS/c13-9(8-5-14-6-11-8)12-7-1-3-10-4-2-7/h1-4,8,11H,5-6H2,(H,10,12,13)
InChIKeyILQMIRBCPCKQDZ-UHFFFAOYSA-N
MW209.27 g/mol
LogP0.68
Rot. Bonds2

About N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide

N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide (PubChem CID 24692510) has the molecular formula C9H11N3OS and a molecular weight of 209.27 g/mol. Its IUPAC name is N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-pyridin-4-yl-1,3-thiazolidine-4-carboxamide
PubChem CID24692510
Molecular FormulaC9H11N3OS
Molecular Weight209.27 g/mol
Exact Mass209.06
IUPAC NameN-pyridin-4-yl-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1ccncc1)C1CSCN1
InChIInChI=1S/C9H11N3OS/c13-9(8-5-14-6-11-8)12-7-1-3-10-4-2-7/h1-4,8,11H,5-6H2,(H,10,12,13)
InChIKeyILQMIRBCPCKQDZ-UHFFFAOYSA-N
XLogP0.68
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide (CID 24692510) is N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide is O=C(Nc1ccncc1)C1CSCN1.
What is the InChIKey of N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide?
The InChIKey is ILQMIRBCPCKQDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3OS/c13-9(8-5-14-6-11-8)12-7-1-3-10-4-2-7/h1-4,8,11H,5-6H2,(H,10,12,13).
What are the key properties of N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide?
N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide has a molecular weight of 209.27 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 24692510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).