N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide

C8H16N2O2S — CID 24706162

IUPACN-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide
SMILESCOCC(C)NC(=O)C1CSCN1
InChIInChI=1S/C8H16N2O2S/c1-6(3-12-2)10-8(11)7-4-13-5-9-7/h6-7,9H,3-5H2,1-2H3,(H,10,11)
InChIKeyXUYDVXOXFDYFJF-UHFFFAOYSA-N
MW204.29 g/mol
LogP-0.20
Rot. Bonds4

About N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide

N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide (PubChem CID 24706162) has the molecular formula C8H16N2O2S and a molecular weight of 204.29 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide
PubChem CID24706162
Molecular FormulaC8H16N2O2S
Molecular Weight204.29 g/mol
Exact Mass204.09
IUPAC NameN-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide
SMILESCOCC(C)NC(=O)C1CSCN1
InChIInChI=1S/C8H16N2O2S/c1-6(3-12-2)10-8(11)7-4-13-5-9-7/h6-7,9H,3-5H2,1-2H3,(H,10,11)
InChIKeyXUYDVXOXFDYFJF-UHFFFAOYSA-N
XLogP-0.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide (CID 24706162) is N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide is COCC(C)NC(=O)C1CSCN1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is XUYDVXOXFDYFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2S/c1-6(3-12-2)10-8(11)7-4-13-5-9-7/h6-7,9H,3-5H2,1-2H3,(H,10,11).
What are the key properties of N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide?
N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 204.29 g/mol, XLogP of -0.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 24706162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).