N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide

C10H11N3O2S2 — CID 5329685

IUPACN-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(SCc2ncc(C)o2)s1
InChIInChI=1S/C10H11N3O2S2/c1-6-3-11-8(15-6)5-16-9-4-12-10(17-9)13-7(2)14/h3-4H,5H2,1-2H3,(H,12,13,14)
InChIKeyAVKWOPNQHZBNAA-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.69
Rot. Bonds4

About N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide

N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 5329685) has the molecular formula C10H11N3O2S2 and a molecular weight of 269.35 g/mol. Its IUPAC name is N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide
PubChem CID5329685
Molecular FormulaC10H11N3O2S2
Molecular Weight269.35 g/mol
Exact Mass269.03
IUPAC NameN-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(SCc2ncc(C)o2)s1
InChIInChI=1S/C10H11N3O2S2/c1-6-3-11-8(15-6)5-16-9-4-12-10(17-9)13-7(2)14/h3-4H,5H2,1-2H3,(H,12,13,14)
InChIKeyAVKWOPNQHZBNAA-UHFFFAOYSA-N
XLogP2.69
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide (CID 5329685) is N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1ncc(SCc2ncc(C)o2)s1.
What is the InChIKey of N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide?
The InChIKey is AVKWOPNQHZBNAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2S2/c1-6-3-11-8(15-6)5-16-9-4-12-10(17-9)13-7(2)14/h3-4H,5H2,1-2H3,(H,12,13,14).
What are the key properties of N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide?
N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 269.35 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(5-methyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 5329685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).