5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide

C8H10ClNO2S — CID 17217261

IUPAC5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide
SMILESCOCCNC(=O)c1ccc(Cl)s1
InChIInChI=1S/C8H10ClNO2S/c1-12-5-4-10-8(11)6-2-3-7(9)13-6/h2-3H,4-5H2,1H3,(H,10,11)
InChIKeyWMGGVSSVZJTOIN-UHFFFAOYSA-N
MW219.69 g/mol
LogP1.78
Rot. Bonds4

About 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide

5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide (PubChem CID 17217261) has the molecular formula C8H10ClNO2S and a molecular weight of 219.69 g/mol. Its IUPAC name is 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide
PubChem CID17217261
Molecular FormulaC8H10ClNO2S
Molecular Weight219.69 g/mol
Exact Mass219.01
IUPAC Name5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide
SMILESCOCCNC(=O)c1ccc(Cl)s1
InChIInChI=1S/C8H10ClNO2S/c1-12-5-4-10-8(11)6-2-3-7(9)13-6/h2-3H,4-5H2,1H3,(H,10,11)
InChIKeyWMGGVSSVZJTOIN-UHFFFAOYSA-N
XLogP1.78
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.69
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-chloro-N-cyclopentylthiophene-2-carboxamide
CID 1244060
Ethyl (5-chlorothiophene-2-carbonyl)glycinate
CID 2225367
N-(3-methoxypropyl)thiophene-2-carboxamide
CID 2057652
N-[(5-Chloro-2-thienyl)carbonyl]glycine
CID 43239030
5-chloro-N-[2-(dimethylamino)ethyl]thiophene-2-carboxamide
CID 1246546
N-(3-ethoxypropyl)thiophene-2-carboxamide
CID 2180987
5-chloro-N-[1-(oxolan-2-yl)ethyl]thiophene-2-carboxamide
CID 2970308
N,N'-butane-1,4-diylbis(5-chlorothiophene-2-carboxamide)
CID 3100298
5-chloro-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 2712625
5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 1246945
5-chloro-N-methylthiophene-2-carboxamide
CID 13411287
(5-Chlorothiophen-2-yl)-pyrrolidin-1-ylmethanone
CID 1247382

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide (CID 17217261) is 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide is COCCNC(=O)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide?
The InChIKey is WMGGVSSVZJTOIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClNO2S/c1-12-5-4-10-8(11)6-2-3-7(9)13-6/h2-3H,4-5H2,1H3,(H,10,11).
What are the key properties of 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide?
5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide has a molecular weight of 219.69 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-methoxyethyl)thiophene-2-carboxamide is sourced from PubChem (CID 17217261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).