5-iodo-N-quinolin-8-ylthiophene-3-carboxamide

C14H9IN2OS — CID 78948742

IUPAC5-iodo-N-quinolin-8-ylthiophene-3-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1csc(I)c1
InChIInChI=1S/C14H9IN2OS/c15-12-7-10(8-19-12)14(18)17-11-5-1-3-9-4-2-6-16-13(9)11/h1-8H,(H,17,18)
InChIKeyGYZVGIRSALNRGA-UHFFFAOYSA-N
MW380.21 g/mol
LogP4.15
Rot. Bonds2

About 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide

5-iodo-N-quinolin-8-ylthiophene-3-carboxamide (PubChem CID 78948742) has the molecular formula C14H9IN2OS and a molecular weight of 380.21 g/mol. Its IUPAC name is 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide.

Molecular Properties

Compound Name5-iodo-N-quinolin-8-ylthiophene-3-carboxamide
PubChem CID78948742
Molecular FormulaC14H9IN2OS
Molecular Weight380.21 g/mol
Exact Mass379.95
IUPAC Name5-iodo-N-quinolin-8-ylthiophene-3-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1csc(I)c1
InChIInChI=1S/C14H9IN2OS/c15-12-7-10(8-19-12)14(18)17-11-5-1-3-9-4-2-6-16-13(9)11/h1-8H,(H,17,18)
InChIKeyGYZVGIRSALNRGA-UHFFFAOYSA-N
XLogP4.15
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.21
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

5-methyl-N-quinolin-8-ylthiophene-3-carboxamide
CID 166451949
N-(3-bromoquinolin-8-yl)-5-iodothiophene-3-carboxamide
CID 116784653
N-[3-(quinolin-8-ylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 27990641
6-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 66463068
2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide
CID 23913298
4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide
CID 103871242
2-hydrazinyl-N-quinolin-8-ylpyridine-4-carboxamide
CID 62235936
5-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 837055
N-quinolin-8-yl-1H-indole-5-carboxamide
CID 110694998
N-quinolin-8-ylpyrazine-2-carboxamide
CID 139088852
1-N-(2-cyanophenyl)-4-N-quinolin-8-ylbenzene-1,4-dicarboxamide
CID 109050221
3,4,5-triethoxy-N-quinolin-8-ylbenzamide
CID 1018003

Frequently Asked Questions

What is the IUPAC name of 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide?
The IUPAC name of 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide (CID 78948742) is 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide.
What is the SMILES notation for 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide?
The canonical SMILES for 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide is O=C(Nc1cccc2cccnc12)c1csc(I)c1.
What is the InChIKey of 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide?
The InChIKey is GYZVGIRSALNRGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9IN2OS/c15-12-7-10(8-19-12)14(18)17-11-5-1-3-9-4-2-6-16-13(9)11/h1-8H,(H,17,18).
What are the key properties of 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide?
5-iodo-N-quinolin-8-ylthiophene-3-carboxamide has a molecular weight of 380.21 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodo-N-quinolin-8-ylthiophene-3-carboxamide is sourced from PubChem (CID 78948742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).