5-chloro-N-ethylthiophene-2-carboxamide

C7H8ClNOS — CID 667834

IUPAC5-chloro-N-ethylthiophene-2-carboxamide
SMILESCCNC(=O)c1ccc(Cl)s1
InChIInChI=1S/C7H8ClNOS/c1-2-9-7(10)5-3-4-6(8)11-5/h3-4H,2H2,1H3,(H,9,10)
InChIKeyDSSUAHIECPEAEG-UHFFFAOYSA-N
MW189.67 g/mol
LogP2.15
Rot. Bonds2

About 5-chloro-N-ethylthiophene-2-carboxamide

5-chloro-N-ethylthiophene-2-carboxamide (PubChem CID 667834) has the molecular formula C7H8ClNOS and a molecular weight of 189.67 g/mol. Its IUPAC name is 5-chloro-N-ethylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-ethylthiophene-2-carboxamide
PubChem CID667834
Molecular FormulaC7H8ClNOS
Molecular Weight189.67 g/mol
Exact Mass189.00
IUPAC Name5-chloro-N-ethylthiophene-2-carboxamide
SMILESCCNC(=O)c1ccc(Cl)s1
InChIInChI=1S/C7H8ClNOS/c1-2-9-7(10)5-3-4-6(8)11-5/h3-4H,2H2,1H3,(H,9,10)
InChIKeyDSSUAHIECPEAEG-UHFFFAOYSA-N
XLogP2.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.67
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-((5-(2-chloroacetyl)thiophen-2-yl)methyl)acetamide
CID 4962027
N-cyclopentyl-5-methylthiophene-2-carboxamide
CID 2373236
5-chloro-N-cyclopentylthiophene-2-carboxamide
CID 1244060
5-Chlorothiophene-2-carboxamide
CID 5172545
Ethyl (5-chlorothiophene-2-carbonyl)glycinate
CID 2225367
N-[(5-Chloro-2-thienyl)carbonyl]glycine
CID 43239030
N-[(5-Acetyl-2-thienyl)methyl]acetamide
CID 7131592
5-chloro-N-[2-(dimethylamino)ethyl]thiophene-2-carboxamide
CID 1246546
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-Chlorothiophen-2-yl)(4-methyl-1,4-diazepan-1-yl)methanone
CID 6467948
5-chloro-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 1246945

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethylthiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-ethylthiophene-2-carboxamide (CID 667834) is 5-chloro-N-ethylthiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-ethylthiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-ethylthiophene-2-carboxamide is CCNC(=O)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-ethylthiophene-2-carboxamide?
The InChIKey is DSSUAHIECPEAEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNOS/c1-2-9-7(10)5-3-4-6(8)11-5/h3-4H,2H2,1H3,(H,9,10).
What are the key properties of 5-chloro-N-ethylthiophene-2-carboxamide?
5-chloro-N-ethylthiophene-2-carboxamide has a molecular weight of 189.67 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethylthiophene-2-carboxamide is sourced from PubChem (CID 667834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).