(4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride

C7H15ClN2OS — CID 130718908

IUPAC(4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCC(C)NC(=O)[C@H]1CSCN1.Cl
InChIInChI=1S/C7H14N2OS.ClH/c1-5(2)9-7(10)6-3-11-4-8-6;/h5-6,8H,3-4H2,1-2H3,(H,9,10);1H/t6-;/m1./s1
InChIKeyGYQXPJCPNKKBKA-FYZOBXCZSA-N
MW210.73 g/mol
LogP0.60
Rot. Bonds2

About (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride

(4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 130718908) has the molecular formula C7H15ClN2OS and a molecular weight of 210.73 g/mol. Its IUPAC name is (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name(4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID130718908
Molecular FormulaC7H15ClN2OS
Molecular Weight210.73 g/mol
Exact Mass210.06
IUPAC Name(4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCC(C)NC(=O)[C@H]1CSCN1.Cl
InChIInChI=1S/C7H14N2OS.ClH/c1-5(2)9-7(10)6-3-11-4-8-6;/h5-6,8H,3-4H2,1-2H3,(H,9,10);1H/t6-;/m1./s1
InChIKeyGYQXPJCPNKKBKA-FYZOBXCZSA-N
XLogP0.60
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.73
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-cyclopentylethyl]-1,3-thiazolidine-4-carboxamide
CID 81391197
N-(3,3-dimethylbutan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 104828221
N-(4-hydroxybutan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 83177193
N-[(2S)-1-(methylamino)-1-oxopropan-2-yl]-1,3-thiazolidine-4-carboxamide
CID 164654399
N-(1-ethylsulfonylpropan-2-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119325433
methyl 3-methyl-2-(1,3-thiazolidine-4-carbonylamino)butanoate
CID 60780380
N-[1-(4-propan-2-ylphenyl)ethyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119269386
N-[4-(propan-2-ylcarbamoyl)phenyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119298473
N-(1-hydroxy-4-methylpentan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 61246752
N-[(2S)-1-hydroxybutan-2-yl]-1,3-thiazolidine-4-carboxamide
CID 107222336
N-(4-ethylsulfanylbutan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 115734458
N-(4-methoxy-4-methylpentan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 119334794

Frequently Asked Questions

What is the IUPAC name of (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 130718908) is (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride is CC(C)NC(=O)[C@H]1CSCN1.Cl.
What is the InChIKey of (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is GYQXPJCPNKKBKA-FYZOBXCZSA-N. The full InChI is InChI=1S/C7H14N2OS.ClH/c1-5(2)9-7(10)6-3-11-4-8-6;/h5-6,8H,3-4H2,1-2H3,(H,9,10);1H/t6-;/m1./s1.
What are the key properties of (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride?
(4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 210.73 g/mol, XLogP of 0.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-propan-2-yl-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 130718908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).