N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide

C18H14ClNO3S — CID 26267194

IUPACN-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide
SMILESCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cccs2)cc1
InChIInChI=1S/C18H14ClNO3S/c1-22-13-5-7-14(8-6-13)23-16-9-4-12(19)11-15(16)20-18(21)17-3-2-10-24-17/h2-11H,1H3,(H,20,21)
InChIKeyGUXSQQFSVNJOCG-UHFFFAOYSA-N
MW359.83 g/mol
LogP5.45
Rot. Bonds5

About N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide

N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide (PubChem CID 26267194) has the molecular formula C18H14ClNO3S and a molecular weight of 359.83 g/mol. Its IUPAC name is N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide
PubChem CID26267194
Molecular FormulaC18H14ClNO3S
Molecular Weight359.83 g/mol
Exact Mass359.04
IUPAC NameN-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide
SMILESCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cccs2)cc1
InChIInChI=1S/C18H14ClNO3S/c1-22-13-5-7-14(8-6-13)23-16-9-4-12(19)11-15(16)20-18(21)17-3-2-10-24-17/h2-11H,1H3,(H,20,21)
InChIKeyGUXSQQFSVNJOCG-UHFFFAOYSA-N
XLogP5.45
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.83
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(E)-N-[5-chloro-2-(4-methoxyphenoxy)phenyl]-3-thiophen-2-ylprop-2-enamide
CID 2101513
N-(5-chloro-2-methylphenyl)thiophene-2-carboxamide
CID 795521
6-chloro-N-[5-chloro-2-(4-methoxyphenoxy)phenyl]pyridine-3-carboxamide
CID 26267192
N-[5-chloro-2-(4-methoxyphenoxy)phenyl]-2-nitrobenzamide
CID 26267184
N-(4-chloro-2-methoxy-5-methylphenyl)thiophene-2-carboxamide
CID 731690
N-(2,5-dimethoxyphenyl)-2-(thiophene-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515404
N-[5-chloro-2-(4-methoxyphenoxy)phenyl]-6-methoxypyridine-3-carboxamide
CID 134056596
N-(5-chloro-2-phenoxyphenyl)benzamide
CID 956230
1-benzyl-N-[5-chloro-2-(4-methoxyphenoxy)phenyl]triazole-4-carboxamide
CID 31858779
N-[5-chloro-2-(4-methoxyphenoxy)phenyl]-2-methyl-1,3-dioxoisoindole-5-carboxamide
CID 55343832
N-(3-chloro-4-methoxyphenyl)thiophene-2-carboxamide
CID 878235
N-[4-chloro-2-(trifluoromethoxy)phenyl]thiophene-2-carboxamide
CID 2741510

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide (CID 26267194) is N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide is COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cccs2)cc1.
What is the InChIKey of N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide?
The InChIKey is GUXSQQFSVNJOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClNO3S/c1-22-13-5-7-14(8-6-13)23-16-9-4-12(19)11-15(16)20-18(21)17-3-2-10-24-17/h2-11H,1H3,(H,20,21).
What are the key properties of N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide?
N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide has a molecular weight of 359.83 g/mol, XLogP of 5.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-2-(4-methoxyphenoxy)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 26267194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).