5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide

C14H9ClN2O2S — CID 47265686

IUPAC5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1cccc(-c2cnco2)c1)c1ccc(Cl)s1
InChIInChI=1S/C14H9ClN2O2S/c15-13-5-4-12(20-13)14(18)17-10-3-1-2-9(6-10)11-7-16-8-19-11/h1-8H,(H,17,18)
InChIKeyKKCXECCBXIFQQU-UHFFFAOYSA-N
MW304.76 g/mol
LogP4.31
Rot. Bonds3

About 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide

5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide (PubChem CID 47265686) has the molecular formula C14H9ClN2O2S and a molecular weight of 304.76 g/mol. Its IUPAC name is 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide
PubChem CID47265686
Molecular FormulaC14H9ClN2O2S
Molecular Weight304.76 g/mol
Exact Mass304.01
IUPAC Name5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1cccc(-c2cnco2)c1)c1ccc(Cl)s1
InChIInChI=1S/C14H9ClN2O2S/c15-13-5-4-12(20-13)14(18)17-10-3-1-2-9(6-10)11-7-16-8-19-11/h1-8H,(H,17,18)
InChIKeyKKCXECCBXIFQQU-UHFFFAOYSA-N
XLogP4.31
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.76
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]pyridine-3-carboxamide
CID 61041502
5-chloro-N-(3-pyridin-2-ylphenyl)thiophene-2-carboxamide
CID 142392244
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide
CID 47051399
2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 47265687
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754
2-(aminomethyl)-N-[3-(1,3-oxazol-5-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 66378031
2-(furan-2-yl)-5-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 55834234
N-[3-(1,3-oxazol-5-yl)phenyl]-4-oxo-1H-pyridine-3-carboxamide
CID 103337290
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]but-2-enamide
CID 47353684
2,4-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]-6-oxopyran-3-carboxamide
CID 71865394
4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide
CID 61102969
5-[3-(1,3-oxazol-5-yl)anilino]-5-oxopentanoic acid
CID 60934205

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide (CID 47265686) is 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide is O=C(Nc1cccc(-c2cnco2)c1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide?
The InChIKey is KKCXECCBXIFQQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2S/c15-13-5-4-12(20-13)14(18)17-10-3-1-2-9(6-10)11-7-16-8-19-11/h1-8H,(H,17,18).
What are the key properties of 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide?
5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide has a molecular weight of 304.76 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 47265686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).