N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide

C8H16N2O2S — CID 65107502

IUPACN-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide
SMILESCC(C)(O)CNC(=O)C1CSCN1
InChIInChI=1S/C8H16N2O2S/c1-8(2,12)4-9-7(11)6-3-13-5-10-6/h6,10,12H,3-5H2,1-2H3,(H,9,11)
InChIKeyJWFCWKFLJRWHAL-UHFFFAOYSA-N
MW204.29 g/mol
LogP-0.46
Rot. Bonds3

About N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide

N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 65107502) has the molecular formula C8H16N2O2S and a molecular weight of 204.29 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide
PubChem CID65107502
Molecular FormulaC8H16N2O2S
Molecular Weight204.29 g/mol
Exact Mass204.09
IUPAC NameN-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide
SMILESCC(C)(O)CNC(=O)C1CSCN1
InChIInChI=1S/C8H16N2O2S/c1-8(2,12)4-9-7(11)6-3-13-5-10-6/h6,10,12H,3-5H2,1-2H3,(H,9,11)
InChIKeyJWFCWKFLJRWHAL-UHFFFAOYSA-N
XLogP-0.46
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl 2-[[(4R)-2-oxothiazolidine-4-carbonyl]amino]acetate
CID 477574
N-(2-Methyl-1,3-thiazolidine-4-carbonyl)glycine
CID 53948971
N-(butan-2-yl)-1,3-thiazolidine-4-carboxamide hydrochloride
CID 47002788
N-(2-methylpropyl)-1,3-thiazolidine-4-carboxamide hydrochloride
CID 47002791
N1-cyclopropyl-N2-(2-hydroxy-2-methyl-3-(methylthio)propyl)oxalamide
CID 71787224
N1-cyclopentyl-N2-(2-hydroxy-2-methyl-4-(methylthio)butyl)oxalamide
CID 71787370
N-(1,3-thiazolidine-4-carbonyl)glycine
CID 61159301
N-(3-methylbutan-2-yl)-1,3-thiazolidine-4-carboxamide
CID 43131419
2-[(2-hydroxy-2-methyl-3-methylsulfanylpropyl)amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 106246953
(4R)-3-(3-amino-2-hydroxypropyl)-N-tert-butyl-1,3-thiazolidine-4-carboxamide
CID 10038310
H-Thz-NH-tBu
CID 10535636
N-[3-methylsulfanyl-1-oxo-1-(1,3-thiazolidin-3-yl)propan-2-yl]acetamide
CID 13048730

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide (CID 65107502) is N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide is CC(C)(O)CNC(=O)C1CSCN1.
What is the InChIKey of N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is JWFCWKFLJRWHAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2S/c1-8(2,12)4-9-7(11)6-3-13-5-10-6/h6,10,12H,3-5H2,1-2H3,(H,9,11).
What are the key properties of N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide?
N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 204.29 g/mol, XLogP of -0.46, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylpropyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 65107502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).