N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide

C12H12N4O2S — CID 61275962

IUPACN-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1ccc(-c2nnco2)cc1)C1CSCN1
InChIInChI=1S/C12H12N4O2S/c17-11(10-5-19-7-13-10)15-9-3-1-8(2-4-9)12-16-14-6-18-12/h1-4,6,10,13H,5,7H2,(H,15,17)
InChIKeyIRLPMBYRWSQLCW-UHFFFAOYSA-N
MW276.32 g/mol
LogP1.34
Rot. Bonds3

About N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide

N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide (PubChem CID 61275962) has the molecular formula C12H12N4O2S and a molecular weight of 276.32 g/mol. Its IUPAC name is N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide
PubChem CID61275962
Molecular FormulaC12H12N4O2S
Molecular Weight276.32 g/mol
Exact Mass276.07
IUPAC NameN-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide
SMILESO=C(Nc1ccc(-c2nnco2)cc1)C1CSCN1
InChIInChI=1S/C12H12N4O2S/c17-11(10-5-19-7-13-10)15-9-3-1-8(2-4-9)12-16-14-6-18-12/h1-4,6,10,13H,5,7H2,(H,15,17)
InChIKeyIRLPMBYRWSQLCW-UHFFFAOYSA-N
XLogP1.34
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-5-oxopiperazine-2-carboxamide
CID 107435761
N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidine-4-carboxamide
CID 61275565
N-pyridin-4-yl-1,3-thiazolidine-4-carboxamide
CID 24692510
2-[[4-(1,3,4-oxadiazol-2-yl)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 60940960
N-(4-tert-butylphenyl)-1,3-thiazolidine-4-carboxamide
CID 24691196
N-[4-(dimethylamino)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43617089
N-[4-(triazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43697835
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazolidine-4-carboxamide
CID 24698635
N-(4-methoxyphenyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 47003209
N-(6-bromo-3-pyridinyl)-1,3-thiazolidine-4-carboxamide
CID 110672131
N-quinoxalin-6-yl-1,3-thiazolidine-4-carboxamide
CID 54862020
N-[4-[(2-methoxyacetyl)amino]phenyl]-1,3-thiazolidine-4-carboxamide
CID 43708166

Frequently Asked Questions

What is the IUPAC name of N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide (CID 61275962) is N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide is O=C(Nc1ccc(-c2nnco2)cc1)C1CSCN1.
What is the InChIKey of N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is IRLPMBYRWSQLCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2S/c17-11(10-5-19-7-13-10)15-9-3-1-8(2-4-9)12-16-14-6-18-12/h1-4,6,10,13H,5,7H2,(H,15,17).
What are the key properties of N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide?
N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 276.32 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 61275962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).