3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide

C10H11N3OS2 — CID 47366067

IUPAC3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
SMILESCCc1ccsc1C(=O)Nc1nnc(C)s1
InChIInChI=1S/C10H11N3OS2/c1-3-7-4-5-15-8(7)9(14)11-10-13-12-6(2)16-10/h4-5H,3H2,1-2H3,(H,11,13,14)
InChIKeyMWHYOVPPCLIPRT-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.72
Rot. Bonds3

About 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide

3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide (PubChem CID 47366067) has the molecular formula C10H11N3OS2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
PubChem CID47366067
Molecular FormulaC10H11N3OS2
Molecular Weight253.35 g/mol
Exact Mass253.03
IUPAC Name3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
SMILESCCc1ccsc1C(=O)Nc1nnc(C)s1
InChIInChI=1S/C10H11N3OS2/c1-3-7-4-5-15-8(7)9(14)11-10-13-12-6(2)16-10/h4-5H,3H2,1-2H3,(H,11,13,14)
InChIKeyMWHYOVPPCLIPRT-UHFFFAOYSA-N
XLogP2.72
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-3-ethylthiophene-2-carboxamide
CID 47374727
N-(1,3-benzothiazol-2-yl)-3-ethylthiophene-2-carboxamide
CID 47365942
3-methyl-N-(5-propyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
CID 34109190
3-ethyl-N-methylthiophene-2-carboxamide
CID 61341196
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-ethylthiophene-2-carboxamide
CID 61389198
3-methyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide
CID 26209843
N-(2-ethylphenyl)-N'-(5-methyl-1,3,4-thiadiazol-2-yl)oxamide
CID 9402959
2-[(3-ethylthiophene-2-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylic acid
CID 61389412
N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide;molecular hydrogen
CID 162747394
N-[4-(diethylamino)phenyl]-3-ethylthiophene-2-carboxamide
CID 60564330
N-(4-carbamothioylphenyl)-3-ethylthiophene-2-carboxamide
CID 79976248
4-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 676913

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide?
The IUPAC name of 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide (CID 47366067) is 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide.
What is the SMILES notation for 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide?
The canonical SMILES for 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide is CCc1ccsc1C(=O)Nc1nnc(C)s1.
What is the InChIKey of 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide?
The InChIKey is MWHYOVPPCLIPRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS2/c1-3-7-4-5-15-8(7)9(14)11-10-13-12-6(2)16-10/h4-5H,3H2,1-2H3,(H,11,13,14).
What are the key properties of 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide?
3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide has a molecular weight of 253.35 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 47366067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).