2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide

C7H10N4OS — CID 123690849

IUPAC2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide
SMILESNC(=O)C1CSC(c2cn[nH]c2)N1
InChIInChI=1S/C7H10N4OS/c8-6(12)5-3-13-7(11-5)4-1-9-10-2-4/h1-2,5,7,11H,3H2,(H2,8,12)(H,9,10)
InChIKeyYLRZEZWNMVARRM-UHFFFAOYSA-N
MW198.25 g/mol
LogP-0.40
Rot. Bonds2

About 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide

2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide (PubChem CID 123690849) has the molecular formula C7H10N4OS and a molecular weight of 198.25 g/mol. Its IUPAC name is 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide
PubChem CID123690849
Molecular FormulaC7H10N4OS
Molecular Weight198.25 g/mol
Exact Mass198.06
IUPAC Name2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide
SMILESNC(=O)C1CSC(c2cn[nH]c2)N1
InChIInChI=1S/C7H10N4OS/c8-6(12)5-3-13-7(11-5)4-1-9-10-2-4/h1-2,5,7,11H,3H2,(H2,8,12)(H,9,10)
InChIKeyYLRZEZWNMVARRM-UHFFFAOYSA-N
XLogP-0.40
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.25
LogP ≤ 5-0.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide
CID 43540266
2-oxo-N-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide
CID 43540360
3-(2-oxo-1,3-thiazolidin-3-yl)-N-(1H-pyrazol-4-ylmethyl)propanamide
CID 60735784
2-(4-oxo-1,3-thiazolidin-3-yl)-N-(1H-pyrazol-4-ylmethyl)acetamide
CID 60735960
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(1H-pyrazol-4-ylmethyl)acetamide
CID 60736231
N-(1H-pyrazol-4-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 61000511
2-oxo-N-(1H-pyrazol-4-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 61004650
(2S)-2-amino-4-methylsulfanyl-N-(1H-pyrazol-4-ylmethyl)butanamide
CID 61163851
(2S)-2-amino-N-methyl-4-methylsulfanyl-N-(1H-pyrazol-4-ylmethyl)butanamide
CID 64046545
N-methyl-2-oxo-N-(1H-pyrazol-4-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 64047283
N-methyl-N-(1H-pyrazol-4-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 64048090
2-(carbamoylamino)-N-methyl-4-methylsulfanyl-N-(1H-pyrazol-4-ylmethyl)butanamide
CID 64052333

Frequently Asked Questions

What is the IUPAC name of 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide (CID 123690849) is 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide is NC(=O)C1CSC(c2cn[nH]c2)N1.
What is the InChIKey of 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is YLRZEZWNMVARRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4OS/c8-6(12)5-3-13-7(11-5)4-1-9-10-2-4/h1-2,5,7,11H,3H2,(H2,8,12)(H,9,10).
What are the key properties of 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide?
2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 198.25 g/mol, XLogP of -0.40, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrazol-4-yl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 123690849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).