N,N-dimethyl-4-phenylthiadiazole-5-carboxamide

C11H11N3OS — CID 2767922

IUPACN,N-dimethyl-4-phenylthiadiazole-5-carboxamide
SMILESCN(C)C(=O)c1snnc1-c1ccccc1
InChIInChI=1S/C11H11N3OS/c1-14(2)11(15)10-9(12-13-16-10)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyGCBZZUUQWDUVQZ-UHFFFAOYSA-N
MW233.30 g/mol
LogP1.91
Rot. Bonds2

About N,N-dimethyl-4-phenylthiadiazole-5-carboxamide

N,N-dimethyl-4-phenylthiadiazole-5-carboxamide (PubChem CID 2767922) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is N,N-dimethyl-4-phenylthiadiazole-5-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-phenylthiadiazole-5-carboxamide
PubChem CID2767922
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC NameN,N-dimethyl-4-phenylthiadiazole-5-carboxamide
SMILESCN(C)C(=O)c1snnc1-c1ccccc1
InChIInChI=1S/C11H11N3OS/c1-14(2)11(15)10-9(12-13-16-10)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyGCBZZUUQWDUVQZ-UHFFFAOYSA-N
XLogP1.91
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Morpholino(4-phenyl-1,2,3-thiadiazol-5-yl)methanone
CID 2767921
N-methyl-4-phenyl-1,2,3-thiadiazole-5-carboxamide
CID 3715739
4-Phenyl-1,2,3-thiadiazole-5-carbohydrazide
CID 2776856
(4-Benzoylpiperidino)(4-methyl-1,2,3-thiadiazol-5-yl)methanone
CID 2740762
4-Phenylthiadiazole-5-carboxamide
CID 2804329
N-benzyl-N-isopropyl-4-methyl-1,2,3-thiadiazole-5-carboxamide
CID 2813487
4-methyl-N-(1-phenylethyl)-1,2,3-thiadiazole-5-carboxamide
CID 6916146
N-[(2,6-difluorophenyl)methyl]-4-methylthiadiazole-5-carboxamide
CID 6917368
4-cyclopropyl-N-[(2-fluorophenyl)methyl]thiadiazole-5-carboxamide
CID 25189476
N-allyl-4-phenyl-1,2,3-thiadiazole-5-carboxamide
CID 2765918
N-(4-fluorobenzyl)-4-methyl-1,2,3-thiadiazole-5-carboxamide
CID 7293423
4-Methyl-N-[(2-methylphenyl)methyl]-1,2,3-thiadiazole-5-carboxamide
CID 9092937

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-phenylthiadiazole-5-carboxamide?
The IUPAC name of N,N-dimethyl-4-phenylthiadiazole-5-carboxamide (CID 2767922) is N,N-dimethyl-4-phenylthiadiazole-5-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-phenylthiadiazole-5-carboxamide?
The canonical SMILES for N,N-dimethyl-4-phenylthiadiazole-5-carboxamide is CN(C)C(=O)c1snnc1-c1ccccc1.
What is the InChIKey of N,N-dimethyl-4-phenylthiadiazole-5-carboxamide?
The InChIKey is GCBZZUUQWDUVQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3OS/c1-14(2)11(15)10-9(12-13-16-10)8-6-4-3-5-7-8/h3-7H,1-2H3.
What are the key properties of N,N-dimethyl-4-phenylthiadiazole-5-carboxamide?
N,N-dimethyl-4-phenylthiadiazole-5-carboxamide has a molecular weight of 233.30 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-phenylthiadiazole-5-carboxamide is sourced from PubChem (CID 2767922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).