N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide

C9H16N2O2S — CID 141137162

IUPACN-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide
SMILESO=C(NC1CCCCO1)N1CCSC1
InChIInChI=1S/C9H16N2O2S/c12-9(11-4-6-14-7-11)10-8-3-1-2-5-13-8/h8H,1-7H2,(H,10,12)
InChIKeyCZZPMWVZRAXHOK-UHFFFAOYSA-N
MW216.31 g/mol
LogP1.23
Rot. Bonds1

About N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide

N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide (PubChem CID 141137162) has the molecular formula C9H16N2O2S and a molecular weight of 216.31 g/mol. Its IUPAC name is N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide.

Molecular Properties

Compound NameN-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide
PubChem CID141137162
Molecular FormulaC9H16N2O2S
Molecular Weight216.31 g/mol
Exact Mass216.09
IUPAC NameN-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide
SMILESO=C(NC1CCCCO1)N1CCSC1
InChIInChI=1S/C9H16N2O2S/c12-9(11-4-6-14-7-11)10-8-3-1-2-5-13-8/h8H,1-7H2,(H,10,12)
InChIKeyCZZPMWVZRAXHOK-UHFFFAOYSA-N
XLogP1.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.31
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentylthiomorpholine-4-carboxamide
CID 115582925
cyclopentyl(1,3-thiazolidin-3-yl)methanone
CID 122331918
N-[(2R)-oxan-2-yl]-2-(phosphanylamino)acetamide
CID 58384212
N-(oxan-2-yl)benzamide
CID 3717262
3-(thiomorpholine-4-carbonylamino)cyclohexane-1-carboxylic acid
CID 63041930
1-cyclododecyl-3-(oxolan-2-yl)urea
CID 108887824
N-morpholin-2-ylpyrrolidine-1-carboxamide
CID 174397928
2-amino-2-cyclohexyl-1-(1,3-thiazolidin-3-yl)ethanone
CID 75031187
(2R)-2-(oxan-2-ylamino)propanoic acid
CID 68789041
4-(1,3-thiazolidine-3-carbonyl)cyclohexan-1-one
CID 122332121
8-[2-(4-cyanophenoxy)ethyl]-N-(oxan-2-yl)-3,8-diazabicyclo[3.2.1]octane-3-carboxamide
CID 22235336
N-[2-(hydroxymethyl)cyclohexyl]morpholine-4-carboxamide
CID 103721884

Frequently Asked Questions

What is the IUPAC name of N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide?
The IUPAC name of N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide (CID 141137162) is N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide.
What is the SMILES notation for N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide?
The canonical SMILES for N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide is O=C(NC1CCCCO1)N1CCSC1.
What is the InChIKey of N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide?
The InChIKey is CZZPMWVZRAXHOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2S/c12-9(11-4-6-14-7-11)10-8-3-1-2-5-13-8/h8H,1-7H2,(H,10,12).
What are the key properties of N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide?
N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide has a molecular weight of 216.31 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-2-yl)-1,3-thiazolidine-3-carboxamide is sourced from PubChem (CID 141137162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).