N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide

C10H15N3O2S — CID 106371148

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCCc1cnc(CNC(=O)C2CSCN2)o1
InChIInChI=1S/C10H15N3O2S/c1-2-7-3-11-9(15-7)4-12-10(14)8-5-16-6-13-8/h3,8,13H,2,4-6H2,1H3,(H,12,14)
InChIKeyCVRPEZMGPXXYBS-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.52
Rot. Bonds4

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 106371148) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide
PubChem CID106371148
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide
SMILESCCc1cnc(CNC(=O)C2CSCN2)o1
InChIInChI=1S/C10H15N3O2S/c1-2-7-3-11-9(15-7)4-12-10(14)8-5-16-6-13-8/h3,8,13H,2,4-6H2,1H3,(H,12,14)
InChIKeyCVRPEZMGPXXYBS-UHFFFAOYSA-N
XLogP0.52
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide (CID 106371148) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide is CCc1cnc(CNC(=O)C2CSCN2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is CVRPEZMGPXXYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c1-2-7-3-11-9(15-7)4-12-10(14)8-5-16-6-13-8/h3,8,13H,2,4-6H2,1H3,(H,12,14).
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 241.32 g/mol, XLogP of 0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 106371148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).