N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide

C10H15N3OS2 — CID 61482668

IUPACN-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide
SMILESCC(C)c1csc(NC(=O)C2CSCN2)n1
InChIInChI=1S/C10H15N3OS2/c1-6(2)7-4-16-10(12-7)13-9(14)8-3-15-5-11-8/h4,6,8,11H,3,5H2,1-2H3,(H,12,13,14)
InChIKeyBURIETBBLBTQIW-UHFFFAOYSA-N
MW257.38 g/mol
LogP1.87
Rot. Bonds3

About N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide

N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide (PubChem CID 61482668) has the molecular formula C10H15N3OS2 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide
PubChem CID61482668
Molecular FormulaC10H15N3OS2
Molecular Weight257.38 g/mol
Exact Mass257.07
IUPAC NameN-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide
SMILESCC(C)c1csc(NC(=O)C2CSCN2)n1
InChIInChI=1S/C10H15N3OS2/c1-6(2)7-4-16-10(12-7)13-9(14)8-3-15-5-11-8/h4,6,8,11H,3,5H2,1-2H3,(H,12,13,14)
InChIKeyBURIETBBLBTQIW-UHFFFAOYSA-N
XLogP1.87
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-(4-propan-2-yl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 61482477
N-(4-cyclopropyl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide
CID 61482512
N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 54958477
methyl 4-[2-(1,3-thiazolidine-4-carbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate
CID 119277943
methyl N-(4-propan-2-yl-1,3-thiazol-2-yl)carbamate
CID 58913263
2-[(4-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 61479820
1-acetyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)azetidine-3-carboxamide
CID 73439343
N-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazolidine-4-carboxamide
CID 24700542
(4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 130718908
methyl 4-[2-(1,3-thiazolidine-4-carbonylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate;hydrochloride
CID 119277942
(2R)-2-amino-N-(4-propan-2-yl-1,3-thiazol-2-yl)propanamide
CID 78973473
N-[1-(4-propan-2-ylphenyl)ethyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119269386

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide (CID 61482668) is N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide is CC(C)c1csc(NC(=O)C2CSCN2)n1.
What is the InChIKey of N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is BURIETBBLBTQIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS2/c1-6(2)7-4-16-10(12-7)13-9(14)8-3-15-5-11-8/h4,6,8,11H,3,5H2,1-2H3,(H,12,13,14).
What are the key properties of N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide?
N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 257.38 g/mol, XLogP of 1.87, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 61482668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).