6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide

C16H14FN3O — CID 144760244

IUPAC6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide
SMILESCNC(=O)c1cnc(-c2ccc3[nH]ccc3c2F)cc1C
InChIInChI=1S/C16H14FN3O/c1-9-7-14(20-8-12(9)16(21)18-2)10-3-4-13-11(15(10)17)5-6-19-13/h3-8,19H,1-2H3,(H,18,21)
InChIKeyFMYCCDDJDLBLFQ-UHFFFAOYSA-N
MW283.31 g/mol
LogP3.04
Rot. Bonds2

About 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide

6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide (PubChem CID 144760244) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide
PubChem CID144760244
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC Name6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide
SMILESCNC(=O)c1cnc(-c2ccc3[nH]ccc3c2F)cc1C
InChIInChI=1S/C16H14FN3O/c1-9-7-14(20-8-12(9)16(21)18-2)10-3-4-13-11(15(10)17)5-6-19-13/h3-8,19H,1-2H3,(H,18,21)
InChIKeyFMYCCDDJDLBLFQ-UHFFFAOYSA-N
XLogP3.04
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide (CID 144760244) is 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide is CNC(=O)c1cnc(-c2ccc3[nH]ccc3c2F)cc1C.
What is the InChIKey of 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide?
The InChIKey is FMYCCDDJDLBLFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c1-9-7-14(20-8-12(9)16(21)18-2)10-3-4-13-11(15(10)17)5-6-19-13/h3-8,19H,1-2H3,(H,18,21).
What are the key properties of 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide?
6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide has a molecular weight of 283.31 g/mol, XLogP of 3.04, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluoro-1H-indol-5-yl)-N,4-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 144760244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).