N-(4-ethylphenyl)thiadiazole-4-carboxamide

C11H11N3OS — CID 1454928

IUPACN-(4-ethylphenyl)thiadiazole-4-carboxamide
SMILESCCc1ccc(NC(=O)c2csnn2)cc1
InChIInChI=1S/C11H11N3OS/c1-2-8-3-5-9(6-4-8)12-11(15)10-7-16-14-13-10/h3-7H,2H2,1H3,(H,12,15)
InChIKeyIORANNDCOYLTKE-UHFFFAOYSA-N
MW233.30 g/mol
LogP2.35
Rot. Bonds3

About N-(4-ethylphenyl)thiadiazole-4-carboxamide

N-(4-ethylphenyl)thiadiazole-4-carboxamide (PubChem CID 1454928) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is N-(4-ethylphenyl)thiadiazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)thiadiazole-4-carboxamide
PubChem CID1454928
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC NameN-(4-ethylphenyl)thiadiazole-4-carboxamide
SMILESCCc1ccc(NC(=O)c2csnn2)cc1
InChIInChI=1S/C11H11N3OS/c1-2-8-3-5-9(6-4-8)12-11(15)10-7-16-14-13-10/h3-7H,2H2,1H3,(H,12,15)
InChIKeyIORANNDCOYLTKE-UHFFFAOYSA-N
XLogP2.35
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(thiadiazole-4-carbonylamino)phenyl]butanoic acid
CID 104501495
N-[4-(3-hydroxyprop-1-ynyl)phenyl]thiadiazole-4-carboxamide
CID 65216612
N-(4-ethylphenyl)-6-methylpyridazine-3-carboxamide
CID 110705292
N-(3-bromo-4-methylphenyl)thiadiazole-4-carboxamide
CID 61068672
N-(4-ethylphenyl)-1,2,5-thiadiazole-3-carboxamide
CID 7213179
6-N-(4-ethylphenyl)-2-N-(4-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100178
N-(2H-benzotriazol-5-yl)thiadiazole-4-carboxamide
CID 71918391
N-(6-amino-3-pyridinyl)thiadiazole-4-carboxamide
CID 65216177
N-(4-ethylphenyl)-6-phenylpyridazine-3-carboxamide
CID 113200612
N-(4-ethylphenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62248142
6-(4-ethylanilino)-N-phenylpyridazine-3-carboxamide
CID 109126657
N-[4-[[(3,5-difluoro-2-methylphenyl)carbamothioylamino]methyl]phenyl]thiadiazole-4-carboxamide
CID 90830649

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)thiadiazole-4-carboxamide?
The IUPAC name of N-(4-ethylphenyl)thiadiazole-4-carboxamide (CID 1454928) is N-(4-ethylphenyl)thiadiazole-4-carboxamide.
What is the SMILES notation for N-(4-ethylphenyl)thiadiazole-4-carboxamide?
The canonical SMILES for N-(4-ethylphenyl)thiadiazole-4-carboxamide is CCc1ccc(NC(=O)c2csnn2)cc1.
What is the InChIKey of N-(4-ethylphenyl)thiadiazole-4-carboxamide?
The InChIKey is IORANNDCOYLTKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3OS/c1-2-8-3-5-9(6-4-8)12-11(15)10-7-16-14-13-10/h3-7H,2H2,1H3,(H,12,15).
What are the key properties of N-(4-ethylphenyl)thiadiazole-4-carboxamide?
N-(4-ethylphenyl)thiadiazole-4-carboxamide has a molecular weight of 233.30 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)thiadiazole-4-carboxamide is sourced from PubChem (CID 1454928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).