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

C11H21ClN2OS — CID 119343824

IUPAC(4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCC1(C)C(NC(=O)[C@H]2CSCN2)C1(C)C.Cl
InChIInChI=1S/C11H20N2OS.ClH/c1-10(2)9(11(10,3)4)13-8(14)7-5-15-6-12-7;/h7,9,12H,5-6H2,1-4H3,(H,13,14);1H/t7-;/m1./s1
InChIKeyGVKOZAZMHIXCLK-OGFXRTJISA-N
MW264.82 g/mol
LogP1.62
Rot. Bonds2

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

(4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119343824) has the molecular formula C11H21ClN2OS and a molecular weight of 264.82 g/mol. Its IUPAC name is (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name(4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119343824
Molecular FormulaC11H21ClN2OS
Molecular Weight264.82 g/mol
Exact Mass264.11
IUPAC Name(4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCC1(C)C(NC(=O)[C@H]2CSCN2)C1(C)C.Cl
InChIInChI=1S/C11H20N2OS.ClH/c1-10(2)9(11(10,3)4)13-8(14)7-5-15-6-12-7;/h7,9,12H,5-6H2,1-4H3,(H,13,14);1H/t7-;/m1./s1
InChIKeyGVKOZAZMHIXCLK-OGFXRTJISA-N
XLogP1.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.82
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119343824) is (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is CC1(C)C(NC(=O)[C@H]2CSCN2)C1(C)C.Cl.
What is the InChIKey of (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is GVKOZAZMHIXCLK-OGFXRTJISA-N. The full InChI is InChI=1S/C11H20N2OS.ClH/c1-10(2)9(11(10,3)4)13-8(14)7-5-15-6-12-7;/h7,9,12H,5-6H2,1-4H3,(H,13,14);1H/t7-;/m1./s1.
What are the key properties of (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
(4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 264.82 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-(2,2,3,3-tetramethylcyclopropyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119343824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).