5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide

C18H12FN3O — CID 113205746

IUPAC5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C18H12FN3O/c19-12-6-7-15-13(9-12)14(10-21-15)18(23)22-16-5-1-3-11-4-2-8-20-17(11)16/h1-10,21H,(H,22,23)
InChIKeyNMVLTXXYZIPTGY-UHFFFAOYSA-N
MW305.31 g/mol
LogP4.11
Rot. Bonds2

About 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide

5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide (PubChem CID 113205746) has the molecular formula C18H12FN3O and a molecular weight of 305.31 g/mol. Its IUPAC name is 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide
PubChem CID113205746
Molecular FormulaC18H12FN3O
Molecular Weight305.31 g/mol
Exact Mass305.10
IUPAC Name5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C18H12FN3O/c19-12-6-7-15-13(9-12)14(10-21-15)18(23)22-16-5-1-3-11-4-2-8-20-17(11)16/h1-10,21H,(H,22,23)
InChIKeyNMVLTXXYZIPTGY-UHFFFAOYSA-N
XLogP4.11
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.31
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-fluoro-1H-indol-3-yl)-2-oxo-N-quinolin-8-ylacetamide
CID 113208175
2-(6-fluoro-1H-indol-3-yl)-2-oxo-N-quinolin-8-ylacetamide
CID 113208706
4-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846864
5-chloro-2-fluoro-N-quinolin-8-ylbenzamide
CID 17416993
4-fluoro-2-(2-pyridin-2-ylphenyl)-N-quinolin-8-ylbenzamide
CID 132546150
3-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846762
5-bromo-2-fluoro-N-quinolin-8-ylbenzamide
CID 24710942
3-chloro-6-fluoro-N-quinolin-8-yl-1-benzothiophene-2-carboxamide
CID 26123631
2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide
CID 105384038
4-amino-N-quinolin-8-yl-1H-pyrrole-2-carboxamide
CID 43642698
5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide
CID 113205928
N-(2,4-difluorophenyl)-N'-quinolin-8-ylpropanediamide
CID 108956736

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide?
The IUPAC name of 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide (CID 113205746) is 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide?
The canonical SMILES for 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide is O=C(Nc1cccc2cccnc12)c1c[nH]c2ccc(F)cc12.
What is the InChIKey of 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide?
The InChIKey is NMVLTXXYZIPTGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN3O/c19-12-6-7-15-13(9-12)14(10-21-15)18(23)22-16-5-1-3-11-4-2-8-20-17(11)16/h1-10,21H,(H,22,23).
What are the key properties of 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide?
5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide has a molecular weight of 305.31 g/mol, XLogP of 4.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-quinolin-8-yl-1H-indole-3-carboxamide is sourced from PubChem (CID 113205746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).