N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide

C7H12F2N2O2S — CID 103796480

IUPACN-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(NCC(O)C(F)F)C1CSCN1
InChIInChI=1S/C7H12F2N2O2S/c8-6(9)5(12)1-10-7(13)4-2-14-3-11-4/h4-6,11-12H,1-3H2,(H,10,13)
InChIKeyAIMVKGVRXSXRSK-UHFFFAOYSA-N
MW226.25 g/mol
LogP-0.61
Rot. Bonds4

About N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide

N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 103796480) has the molecular formula C7H12F2N2O2S and a molecular weight of 226.25 g/mol. Its IUPAC name is N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide
PubChem CID103796480
Molecular FormulaC7H12F2N2O2S
Molecular Weight226.25 g/mol
Exact Mass226.06
IUPAC NameN-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(NCC(O)C(F)F)C1CSCN1
InChIInChI=1S/C7H12F2N2O2S/c8-6(9)5(12)1-10-7(13)4-2-14-3-11-4/h4-6,11-12H,1-3H2,(H,10,13)
InChIKeyAIMVKGVRXSXRSK-UHFFFAOYSA-N
XLogP-0.61
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 5-0.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-N-(2-hydroxyethyl)-4-(trifluoromethylsulfanyl)butanamide
CID 59253801
N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazolidine-4-carboxamide
CID 60952485
N-[2-(2,2,2-trifluoroethoxy)ethyl]-1,3-thiazolidine-4-carboxamide
CID 63827767
2-[1,3-Thiazolidine-4-carbonyl(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258411
2-oxo-N-(3,3,3-trifluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide
CID 103755811
N-(3,3-difluoro-2-hydroxypropyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 103770387
N-(3,3-difluoro-2-hydroxypropyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 103770465
N-(3,3,3-trifluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide
CID 103795762
(2S)-2-amino-4-methylsulfanyl-N-(3,3,3-trifluoro-2-hydroxypropyl)butanamide
CID 103795772
(2S)-2-amino-N-(3,3-difluoro-2-hydroxypropyl)-4-methylsulfanylbutanamide
CID 103796489
N-(2-hydroxyethyl)-2-oxo-N-(2,2,2-trifluoroethyl)-1,3-thiazolidine-4-carboxamide
CID 103915375
N-(2,2-difluoro-3-hydroxypropyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 104862822

Frequently Asked Questions

What is the IUPAC name of N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide (CID 103796480) is N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide is O=C(NCC(O)C(F)F)C1CSCN1.
What is the InChIKey of N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is AIMVKGVRXSXRSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F2N2O2S/c8-6(9)5(12)1-10-7(13)4-2-14-3-11-4/h4-6,11-12H,1-3H2,(H,10,13).
What are the key properties of N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide?
N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 226.25 g/mol, XLogP of -0.61, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-difluoro-2-hydroxypropyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 103796480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).