2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide

C15H13FN2O — CID 140712018

IUPAC2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1[C@@H]1CCc2ccc(F)cc21
InChIInChI=1S/C15H13FN2O/c16-10-5-3-9-4-6-11(13(9)8-10)14-12(15(17)19)2-1-7-18-14/h1-3,5,7-8,11H,4,6H2,(H2,17,19)/t11-/m1/s1
InChIKeyYGVVBHKZHCDWCS-LLVKDONJSA-N
MW256.28 g/mol
LogP2.40
Rot. Bonds2

About 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide

2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide (PubChem CID 140712018) has the molecular formula C15H13FN2O and a molecular weight of 256.28 g/mol. Its IUPAC name is 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide
PubChem CID140712018
Molecular FormulaC15H13FN2O
Molecular Weight256.28 g/mol
Exact Mass256.10
IUPAC Name2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1[C@@H]1CCc2ccc(F)cc21
InChIInChI=1S/C15H13FN2O/c16-10-5-3-9-4-6-11(13(9)8-10)14-12(15(17)19)2-1-7-18-14/h1-3,5,7-8,11H,4,6H2,(H2,17,19)/t11-/m1/s1
InChIKeyYGVVBHKZHCDWCS-LLVKDONJSA-N
XLogP2.40
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.28
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide?
The IUPAC name of 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide (CID 140712018) is 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide.
What is the SMILES notation for 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide?
The canonical SMILES for 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide is NC(=O)c1cccnc1[C@@H]1CCc2ccc(F)cc21.
What is the InChIKey of 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide?
The InChIKey is YGVVBHKZHCDWCS-LLVKDONJSA-N. The full InChI is InChI=1S/C15H13FN2O/c16-10-5-3-9-4-6-11(13(9)8-10)14-12(15(17)19)2-1-7-18-14/h1-3,5,7-8,11H,4,6H2,(H2,17,19)/t11-/m1/s1.
What are the key properties of 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide?
2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide has a molecular weight of 256.28 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-6-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 140712018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).