2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide

C24H16N4O2S — CID 23913298

IUPAC2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide
SMILESO=C(Nc1cccc2cccnc12)c1ccc(C(=O)Nc2cccc3cccnc23)s1
InChIInChI=1S/C24H16N4O2S/c29-23(27-17-9-1-5-15-7-3-13-25-21(15)17)19-11-12-20(31-19)24(30)28-18-10-2-6-16-8-4-14-26-22(16)18/h1-14H,(H,27,29)(H,28,30)
InChIKeyKJUJOJSRFCYADY-UHFFFAOYSA-N
MW424.49 g/mol
LogP5.35
Rot. Bonds4

About 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide

2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide (PubChem CID 23913298) has the molecular formula C24H16N4O2S and a molecular weight of 424.49 g/mol. Its IUPAC name is 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide
PubChem CID23913298
Molecular FormulaC24H16N4O2S
Molecular Weight424.49 g/mol
Exact Mass424.10
IUPAC Name2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide
SMILESO=C(Nc1cccc2cccnc12)c1ccc(C(=O)Nc2cccc3cccnc23)s1
InChIInChI=1S/C24H16N4O2S/c29-23(27-17-9-1-5-15-7-3-13-25-21(15)17)19-11-12-20(31-19)24(30)28-18-10-2-6-16-8-4-14-26-22(16)18/h1-14H,(H,27,29)(H,28,30)
InChIKeyKJUJOJSRFCYADY-UHFFFAOYSA-N
XLogP5.35
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.49
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(phenylcarbamoylamino)-N-quinolin-8-ylthiophene-2-carboxamide
CID 78846872
6-chloro-N-quinolin-8-ylpyridine-2-carboxamide
CID 62235243
5-iodo-N-quinolin-8-ylthiophene-3-carboxamide
CID 78948742
N-quinolin-8-ylpyrazine-2-carboxamide
CID 139088852
5-methyl-N-quinolin-8-ylthiophene-3-carboxamide
CID 166451949
N-[3-(quinolin-8-ylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 27990641
N-quinolin-8-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole-6-carboxamide
CID 110384743
(5R)-5-methyl-N-quinolin-8-yl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 40813465
2-bromo-6-hydroxy-N-quinolin-8-ylbenzamide
CID 174610823
6-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103186933
5-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103817057
2-fluoro-N-quinolin-8-ylacetamide
CID 175257606

Frequently Asked Questions

What is the IUPAC name of 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide?
The IUPAC name of 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide (CID 23913298) is 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide.
What is the SMILES notation for 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide?
The canonical SMILES for 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide is O=C(Nc1cccc2cccnc12)c1ccc(C(=O)Nc2cccc3cccnc23)s1.
What is the InChIKey of 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide?
The InChIKey is KJUJOJSRFCYADY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N4O2S/c29-23(27-17-9-1-5-15-7-3-13-25-21(15)17)19-11-12-20(31-19)24(30)28-18-10-2-6-16-8-4-14-26-22(16)18/h1-14H,(H,27,29)(H,28,30).
What are the key properties of 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide?
2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide has a molecular weight of 424.49 g/mol, XLogP of 5.35, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide is sourced from PubChem (CID 23913298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).