5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide

C11H11N3O2S2 — CID 30768610

IUPAC5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide
SMILESO=C(CCCC(=O)c1cccs1)Nc1nncs1
InChIInChI=1S/C11H11N3O2S2/c15-8(9-4-2-6-17-9)3-1-5-10(16)13-11-14-12-7-18-11/h2,4,6-7H,1,3,5H2,(H,13,14,16)
InChIKeyVPZOVNHPDZBREN-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.59
Rot. Bonds6

About 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide

5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide (PubChem CID 30768610) has the molecular formula C11H11N3O2S2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide.

Molecular Properties

Compound Name5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide
PubChem CID30768610
Molecular FormulaC11H11N3O2S2
Molecular Weight281.36 g/mol
Exact Mass281.03
IUPAC Name5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide
SMILESO=C(CCCC(=O)c1cccs1)Nc1nncs1
InChIInChI=1S/C11H11N3O2S2/c15-8(9-4-2-6-17-9)3-1-5-10(16)13-11-14-12-7-18-11/h2,4,6-7H,1,3,5H2,(H,13,14,16)
InChIKeyVPZOVNHPDZBREN-UHFFFAOYSA-N
XLogP2.59
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-oxo-2-(1,3,4-thiadiazol-2-ylamino)ethyl]thiophene-2-carboxamide
CID 29370149
N-(1,3,4-thiadiazol-2-yl)-3-thiophen-2-ylpropanamide
CID 29369897
N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-thiophen-2-ylbutanamide
CID 31265005
N-(6-bromo-3-pyridinyl)-5-oxo-5-thiophen-2-ylpentanamide
CID 110619359
4-oxo-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-4-thiophen-2-ylbutanamide
CID 46542151
N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-5-thiophen-2-ylpentanamide
CID 24666179
N-(2-methylpropyl)-5-oxo-5-thiophen-2-ylpentanamide
CID 110298004
N-[4-[2-oxo-2-(1,3,4-thiadiazol-2-ylamino)ethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 29369939
5-oxo-N-(4-propan-2-yloxyphenyl)-5-thiophen-2-ylpentanamide
CID 110298049
4-amino-1-thiophen-2-ylbutan-1-one
CID 55267003
5-hydroxy-1-thiophen-2-ylpentan-1-one
CID 102168662
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-thiophen-2-ylbutanamide
CID 2397239

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide?
The IUPAC name of 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide (CID 30768610) is 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide.
What is the SMILES notation for 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide?
The canonical SMILES for 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide is O=C(CCCC(=O)c1cccs1)Nc1nncs1.
What is the InChIKey of 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide?
The InChIKey is VPZOVNHPDZBREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2S2/c15-8(9-4-2-6-17-9)3-1-5-10(16)13-11-14-12-7-18-11/h2,4,6-7H,1,3,5H2,(H,13,14,16).
What are the key properties of 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide?
5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide has a molecular weight of 281.36 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(1,3,4-thiadiazol-2-yl)-5-thiophen-2-ylpentanamide is sourced from PubChem (CID 30768610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).