N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide

C15H13FN2O — CID 113442142

IUPACN-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide
SMILESO=C(NC1Cc2ccccc2C1)c1cccc(F)n1
InChIInChI=1S/C15H13FN2O/c16-14-7-3-6-13(18-14)15(19)17-12-8-10-4-1-2-5-11(10)9-12/h1-7,12H,8-9H2,(H,17,19)
InChIKeyKPOPUNDKHXHOKF-UHFFFAOYSA-N
MW256.28 g/mol
LogP2.12
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide

N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide (PubChem CID 113442142) has the molecular formula C15H13FN2O and a molecular weight of 256.28 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide
PubChem CID113442142
Molecular FormulaC15H13FN2O
Molecular Weight256.28 g/mol
Exact Mass256.10
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide
SMILESO=C(NC1Cc2ccccc2C1)c1cccc(F)n1
InChIInChI=1S/C15H13FN2O/c16-14-7-3-6-13(18-14)15(19)17-12-8-10-4-1-2-5-11(10)9-12/h1-7,12H,8-9H2,(H,17,19)
InChIKeyKPOPUNDKHXHOKF-UHFFFAOYSA-N
XLogP2.12
TPSA41.99 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 ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-fluoro-N-(1-methylsulfonylpiperidin-4-yl)pyridine-2-carboxamide
CID 115497114
2-amino-N-(2,3-dihydro-1H-inden-2-yl)-1,3-thiazole-4-carboxamide
CID 107842728
N-(2,3-dihydro-1H-inden-2-yl)benzamide
CID 2823441
6-fluoro-N-(1-methyl-2,5-dioxopyrrolidin-3-yl)pyridine-2-carboxamide
CID 115497964
6-fluoro-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pyridine-2-carboxamide
CID 115497212
N-(1-ethylpiperidin-3-yl)-6-fluoropyridine-2-carboxamide
CID 113323521
N-(2,3-dihydro-1H-inden-2-yl)-2-fluoropyridine-3-carboxamide
CID 114037815
6-fluoro-N-(2-methyloxolan-3-yl)pyridine-2-carboxamide
CID 82726069
6-fluoro-N-(2-methylcycloheptyl)pyridine-2-carboxamide
CID 115497960
N-(2,2-dimethylcyclopentyl)-6-fluoropyridine-2-carboxamide
CID 115498008
N-(2,3-dihydro-1H-inden-2-yl)-5-methyl-1H-pyrazole-3-carboxamide
CID 90967948
2-N-cycloheptyl-6-N-cyclohexylpyridine-2,6-dicarboxamide
CID 109095319

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide (CID 113442142) is N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide is O=C(NC1Cc2ccccc2C1)c1cccc(F)n1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide?
The InChIKey is KPOPUNDKHXHOKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O/c16-14-7-3-6-13(18-14)15(19)17-12-8-10-4-1-2-5-11(10)9-12/h1-7,12H,8-9H2,(H,17,19).
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide?
N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide has a molecular weight of 256.28 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-6-fluoropyridine-2-carboxamide is sourced from PubChem (CID 113442142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).