(4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride

C8H11ClN2OS2 — CID 119326722

IUPAC(4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccsc1)[C@H]1CSCN1
InChIInChI=1S/C8H10N2OS2.ClH/c11-8(7-4-13-5-9-7)10-6-1-2-12-3-6;/h1-3,7,9H,4-5H2,(H,10,11);1H/t7-;/m1./s1
InChIKeyDANJPNNKVSTKTP-OGFXRTJISA-N
MW250.78 g/mol
LogP1.77
Rot. Bonds2

About (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride

(4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119326722) has the molecular formula C8H11ClN2OS2 and a molecular weight of 250.78 g/mol. Its IUPAC name is (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name(4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119326722
Molecular FormulaC8H11ClN2OS2
Molecular Weight250.78 g/mol
Exact Mass250.00
IUPAC Name(4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccsc1)[C@H]1CSCN1
InChIInChI=1S/C8H10N2OS2.ClH/c11-8(7-4-13-5-9-7)10-6-1-2-12-3-6;/h1-3,7,9H,4-5H2,(H,10,11);1H/t7-;/m1./s1
InChIKeyDANJPNNKVSTKTP-OGFXRTJISA-N
XLogP1.77
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.78
LogP ≤ 51.77
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-thiophen-3-ylpiperidine-2-carboxamide
CID 66352407
N-(4-methoxyphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 47003209
N-(3,4-dimethylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 50988129
N-(3,4-difluorophenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119263074
N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119832878
N-(4-tert-butylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24691196
N-[4-(dimethylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43617089
N-(3-methylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24689839
N-(4-tert-butylsulfanylphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119042537
N-(4-bromo-3,5-dimethylphenyl)-1,3-thiazolidine-4-carboxamide
CID 107574265
N-[3-[(dimethylamino)methyl]phenyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119853195

Frequently Asked Questions

What is the IUPAC name of (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119326722) is (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride is Cl.O=C(Nc1ccsc1)[C@H]1CSCN1.
What is the InChIKey of (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is DANJPNNKVSTKTP-OGFXRTJISA-N. The full InChI is InChI=1S/C8H10N2OS2.ClH/c11-8(7-4-13-5-9-7)10-6-1-2-12-3-6;/h1-3,7,9H,4-5H2,(H,10,11);1H/t7-;/m1./s1.
What are the key properties of (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride?
(4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 250.78 g/mol, XLogP of 1.77, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-thiophen-3-yl-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119326722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).