N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride

C10H15Cl2N3OS — CID 119832878

IUPACN-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
SMILESCc1cc(NC(=O)C2CSCN2)ccn1.Cl.Cl
InChIInChI=1S/C10H13N3OS.2ClH/c1-7-4-8(2-3-11-7)13-10(14)9-5-15-6-12-9;;/h2-4,9,12H,5-6H2,1H3,(H,11,13,14);2*1H
InChIKeyRESAKAOOXBPWBB-UHFFFAOYSA-N
MW296.22 g/mol
LogP1.83
Rot. Bonds2

About N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride

N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride (PubChem CID 119832878) has the molecular formula C10H15Cl2N3OS and a molecular weight of 296.22 g/mol. Its IUPAC name is N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
PubChem CID119832878
Molecular FormulaC10H15Cl2N3OS
Molecular Weight296.22 g/mol
Exact Mass295.03
IUPAC NameN-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
SMILESCc1cc(NC(=O)C2CSCN2)ccn1.Cl.Cl
InChIInChI=1S/C10H13N3OS.2ClH/c1-7-4-8(2-3-11-7)13-10(14)9-5-15-6-12-9;;/h2-4,9,12H,5-6H2,1H3,(H,11,13,14);2*1H
InChIKeyRESAKAOOXBPWBB-UHFFFAOYSA-N
XLogP1.83
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.22
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide
CID 24692510
N-(3,4-dimethylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 50988129
N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide
CID 54862020
N-(3-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24689839
(4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119326722
N-(4-carbamoyl-3-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119318629
N-(3,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119263074
(2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide
CID 126623254
N-(4-bromo-3,5-dimethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 107574265
N-[3-(2-methylpropanoylamino)phenyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119281758
N-[3-(1H-pyrazol-5-yl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43711254
N-(2-methyl-1,3-benzothiazol-6-yl)-1,3-thiazolidine-4-carboxamide
CID 43702559

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride?
The IUPAC name of N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride (CID 119832878) is N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride.
What is the SMILES notation for N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride?
The canonical SMILES for N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride is Cc1cc(NC(=O)C2CSCN2)ccn1.Cl.Cl.
What is the InChIKey of N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride?
The InChIKey is RESAKAOOXBPWBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS.2ClH/c1-7-4-8(2-3-11-7)13-10(14)9-5-15-6-12-9;;/h2-4,9,12H,5-6H2,1H3,(H,11,13,14);2*1H.
What are the key properties of N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride?
N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride has a molecular weight of 296.22 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 119832878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).