N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride

C11H15ClN2OS — CID 47002966

IUPACN-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCc1ccccc1NC(=O)C1CSCN1.Cl
InChIInChI=1S/C11H14N2OS.ClH/c1-8-4-2-3-5-9(8)13-11(14)10-6-15-7-12-10;/h2-5,10,12H,6-7H2,1H3,(H,13,14);1H
InChIKeyIDNYEZURHVEVEP-UHFFFAOYSA-N
MW258.77 g/mol
LogP2.02
Rot. Bonds2

About N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride

N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 47002966) has the molecular formula C11H15ClN2OS and a molecular weight of 258.77 g/mol. Its IUPAC name is N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID47002966
Molecular FormulaC11H15ClN2OS
Molecular Weight258.77 g/mol
Exact Mass258.06
IUPAC NameN-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCc1ccccc1NC(=O)C1CSCN1.Cl
InChIInChI=1S/C11H14N2OS.ClH/c1-8-4-2-3-5-9(8)13-11(14)10-6-15-7-12-10;/h2-5,10,12H,6-7H2,1H3,(H,13,14);1H
InChIKeyIDNYEZURHVEVEP-UHFFFAOYSA-N
XLogP2.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.77
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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3-[4-(4-o-Tolyl-piperazin-1-yl)-butyl]-thiazolidin-4-one
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5,5-Dimethyl-3-[4-(4-o-tolyl-piperazin-1-yl)-butyl]-thiazolidin-4-one
CID 10666322
(4R)-2-(4-acetamidophenyl)-N-tetradecyl-1,3-thiazolidine-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 47002966) is N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is Cc1ccccc1NC(=O)C1CSCN1.Cl.
What is the InChIKey of N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is IDNYEZURHVEVEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2OS.ClH/c1-8-4-2-3-5-9(8)13-11(14)10-6-15-7-12-10;/h2-5,10,12H,6-7H2,1H3,(H,13,14);1H.
What are the key properties of N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 258.77 g/mol, XLogP of 2.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 47002966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).