N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide

C14H14N6O3S — CID 75538349

IUPACN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
SMILESCCc1nnc(NC(=O)COCc2nc(-c3ccncc3)no2)s1
InChIInChI=1S/C14H14N6O3S/c1-2-12-18-19-14(24-12)16-10(21)7-22-8-11-17-13(20-23-11)9-3-5-15-6-4-9/h3-6H,2,7-8H2,1H3,(H,16,19,21)
InChIKeyXPVINFJCZYYITP-UHFFFAOYSA-N
MW346.37 g/mol
LogP1.70
Rot. Bonds7

About N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide (PubChem CID 75538349) has the molecular formula C14H14N6O3S and a molecular weight of 346.37 g/mol. Its IUPAC name is N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
PubChem CID75538349
Molecular FormulaC14H14N6O3S
Molecular Weight346.37 g/mol
Exact Mass346.08
IUPAC NameN-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
SMILESCCc1nnc(NC(=O)COCc2nc(-c3ccncc3)no2)s1
InChIInChI=1S/C14H14N6O3S/c1-2-12-18-19-14(24-12)16-10(21)7-22-8-11-17-13(20-23-11)9-3-5-15-6-4-9/h3-6H,2,7-8H2,1H3,(H,16,19,21)
InChIKeyXPVINFJCZYYITP-UHFFFAOYSA-N
XLogP1.70
TPSA115.92 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.37
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 71828845
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 17354611
2-ethoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]acetamide
CID 71800533
N-[(2-fluorophenyl)methyl]-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
CID 75538356
3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)propanamide
CID 17354575
2-(2-butoxyethoxy)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
CID 11778819
3-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide
CID 18148953
1-(4-propan-2-ylsulfonylpiperazin-1-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]ethanone
CID 75538362
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 26051072
N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-2-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]acetamide
CID 46266527
N-(5,6-dimethoxy-1,3-benzothiazol-2-yl)-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 30216008
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 51142621

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The IUPAC name of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide (CID 75538349) is N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide.
What is the SMILES notation for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The canonical SMILES for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide is CCc1nnc(NC(=O)COCc2nc(-c3ccncc3)no2)s1.
What is the InChIKey of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The InChIKey is XPVINFJCZYYITP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6O3S/c1-2-12-18-19-14(24-12)16-10(21)7-22-8-11-17-13(20-23-11)9-3-5-15-6-4-9/h3-6H,2,7-8H2,1H3,(H,16,19,21).
What are the key properties of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide has a molecular weight of 346.37 g/mol, XLogP of 1.70, 7 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide is sourced from PubChem (CID 75538349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).