N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide

C17H20N4O2S — CID 35945644

IUPACN-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide
SMILESCCc1nnsc1C(=O)N1CCC(NC(=O)c2ccccc2)CC1
InChIInChI=1S/C17H20N4O2S/c1-2-14-15(24-20-19-14)17(23)21-10-8-13(9-11-21)18-16(22)12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,18,22)
InChIKeyNTRMEVXGFGNVTP-UHFFFAOYSA-N
MW344.44 g/mol
LogP2.14
Rot. Bonds4

About N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide

N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide (PubChem CID 35945644) has the molecular formula C17H20N4O2S and a molecular weight of 344.44 g/mol. Its IUPAC name is N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide
PubChem CID35945644
Molecular FormulaC17H20N4O2S
Molecular Weight344.44 g/mol
Exact Mass344.13
IUPAC NameN-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide
SMILESCCc1nnsc1C(=O)N1CCC(NC(=O)c2ccccc2)CC1
InChIInChI=1S/C17H20N4O2S/c1-2-14-15(24-20-19-14)17(23)21-10-8-13(9-11-21)18-16(22)12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,18,22)
InChIKeyNTRMEVXGFGNVTP-UHFFFAOYSA-N
XLogP2.14
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]-4-fluorobenzamide
CID 32512747
4-ethyl-N-[1-(furan-3-carbonyl)piperidin-4-yl]thiadiazole-5-carboxamide
CID 38213671
N'-benzoyl-4-ethylthiadiazole-5-carbohydrazide
CID 46522979
[4-(cyclopropylmethylamino)piperidin-1-yl]-(4-ethylthiadiazol-5-yl)methanone;hydrochloride
CID 119622207
4-ethyl-N-(1-ethylpiperidin-4-yl)thiadiazole-5-carboxamide
CID 30768347
(4-ethylthiadiazol-5-yl)-[4-(methylaminomethyl)piperidin-1-yl]methanone;hydrochloride
CID 119543322
(3S)-1-(4-ethylthiadiazole-5-carbonyl)pyrrolidine-3-carboxylic acid
CID 124512511
ethyl 4-benzamidopiperidine-1-carboxylate
CID 18120666
[4-(2,6-dimethylphenoxy)piperidin-1-yl]-(4-ethylthiadiazol-5-yl)methanone
CID 56814277
N-(1-benzoylpiperidin-4-yl)-4-phenylbenzamide
CID 108549483
N-[1-(N'-methylcarbamimidoyl)piperidin-4-yl]benzamide
CID 123463757
N-[1-[2-(methylamino)acetyl]piperidin-4-yl]benzamide
CID 119698218

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide?
The IUPAC name of N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide (CID 35945644) is N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide.
What is the SMILES notation for N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide?
The canonical SMILES for N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide is CCc1nnsc1C(=O)N1CCC(NC(=O)c2ccccc2)CC1.
What is the InChIKey of N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide?
The InChIKey is NTRMEVXGFGNVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2S/c1-2-14-15(24-20-19-14)17(23)21-10-8-13(9-11-21)18-16(22)12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,18,22).
What are the key properties of N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide?
N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide has a molecular weight of 344.44 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 35945644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).