4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide

C13H13ClN2O3S — CID 146323371

IUPAC4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide
SMILESCCn1cc(NC(=O)c2cc(Cl)c(OC)s2)ccc1=O
InChIInChI=1S/C13H13ClN2O3S/c1-3-16-7-8(4-5-11(16)17)15-12(18)10-6-9(14)13(19-2)20-10/h4-7H,3H2,1-2H3,(H,15,18)
InChIKeyYHZPUUHODAWNBZ-UHFFFAOYSA-N
MW312.78 g/mol
LogP2.84
Rot. Bonds4

About 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide

4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide (PubChem CID 146323371) has the molecular formula C13H13ClN2O3S and a molecular weight of 312.78 g/mol. Its IUPAC name is 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide
PubChem CID146323371
Molecular FormulaC13H13ClN2O3S
Molecular Weight312.78 g/mol
Exact Mass312.03
IUPAC Name4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide
SMILESCCn1cc(NC(=O)c2cc(Cl)c(OC)s2)ccc1=O
InChIInChI=1S/C13H13ClN2O3S/c1-3-16-7-8(4-5-11(16)17)15-12(18)10-6-9(14)13(19-2)20-10/h4-7H,3H2,1-2H3,(H,15,18)
InChIKeyYHZPUUHODAWNBZ-UHFFFAOYSA-N
XLogP2.84
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.78
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4,5-dichloro-N-(1-ethyl-6-oxo-3-pyridinyl)thiophene-2-carboxamide
CID 146323464
4,5-dichloro-N-(1-ethyl-5-methoxy-6-oxo-3-pyridinyl)thiophene-2-carboxamide
CID 146323367
3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
CID 47255035
5-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-1-methylpyrrole-3-carboxamide
CID 146323461
5-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-6-methylpyridine-2-carboxamide
CID 167694658
5-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-1-methylpyrazole-3-carboxamide
CID 146323320
N-[1-[(2-chlorophenyl)methyl]-6-oxo-3-pyridinyl]-4-ethyl-5-methylthiophene-2-carboxamide
CID 55804395
2-amino-6-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
CID 63658779
2-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-6-methoxybenzamide
CID 81393711
2-chloro-5-(diethylsulfamoyl)-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
CID 60552239
N-(1-ethyl-6-oxo-3-pyridinyl)-4-fluorobenzamide
CID 47254966
N-(1-ethyl-6-oxo-3-pyridinyl)-1,4-dimethylpyrrole-2-carboxamide
CID 153398122

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide?
The IUPAC name of 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide (CID 146323371) is 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide.
What is the SMILES notation for 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide?
The canonical SMILES for 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide is CCn1cc(NC(=O)c2cc(Cl)c(OC)s2)ccc1=O.
What is the InChIKey of 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide?
The InChIKey is YHZPUUHODAWNBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2O3S/c1-3-16-7-8(4-5-11(16)17)15-12(18)10-6-9(14)13(19-2)20-10/h4-7H,3H2,1-2H3,(H,15,18).
What are the key properties of 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide?
4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide has a molecular weight of 312.78 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-5-methoxythiophene-2-carboxamide is sourced from PubChem (CID 146323371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).