N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide

C15H13FN2O — CID 47380307

IUPACN-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide
SMILESO=C(NC1CCc2c(F)cccc21)c1ccccn1
InChIInChI=1S/C15H13FN2O/c16-12-5-3-4-11-10(12)7-8-13(11)18-15(19)14-6-1-2-9-17-14/h1-6,9,13H,7-8H2,(H,18,19)
InChIKeySHMCWIUPOQFVIH-UHFFFAOYSA-N
MW256.28 g/mol
LogP2.64
Rot. Bonds2

About N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide

N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide (PubChem CID 47380307) has the molecular formula C15H13FN2O and a molecular weight of 256.28 g/mol. Its IUPAC name is N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide
PubChem CID47380307
Molecular FormulaC15H13FN2O
Molecular Weight256.28 g/mol
Exact Mass256.10
IUPAC NameN-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide
SMILESO=C(NC1CCc2c(F)cccc21)c1ccccn1
InChIInChI=1S/C15H13FN2O/c16-12-5-3-4-11-10(12)7-8-13(11)18-15(19)14-6-1-2-9-17-14/h1-6,9,13H,7-8H2,(H,18,19)
InChIKeySHMCWIUPOQFVIH-UHFFFAOYSA-N
XLogP2.64
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 ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-4-fluoro-2,3-dihydro-1H-inden-1-yl]-2-methylpyridine-3-carboxamide
CID 142729745
N-[(1R)-4-fluoro-2,3-dihydro-1H-inden-1-yl]pyridine-3-carboxamide
CID 94198155
N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(2-methoxyethoxy)benzamide
CID 86833068
2,6-difluoro-N-[(1S)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]benzamide
CID 95934372
2-methyl-N-(4-methyl-2,3-dihydro-1H-inden-1-yl)pyrimidine-4-carboxamide
CID 166195499
2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120975454
(2R)-2-amino-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)propanamide
CID 119302149
N-[(3R)-2,6-dioxopiperidin-3-yl]pyridine-2-carboxamide
CID 175992021
N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
CID 167956409
2,5-dibromo-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)thiophene-3-carboxamide
CID 86963003
3-(dimethylamino)-N-[(1S)-4-fluoro-2,3-dihydro-1H-inden-1-yl]cyclobutane-1-carboxamide
CID 166285451
N-[(1S)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-6-methylpyridine-2-carboxamide
CID 96517026

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide (CID 47380307) is N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide is O=C(NC1CCc2c(F)cccc21)c1ccccn1.
What is the InChIKey of N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide?
The InChIKey is SHMCWIUPOQFVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O/c16-12-5-3-4-11-10(12)7-8-13(11)18-15(19)14-6-1-2-9-17-14/h1-6,9,13H,7-8H2,(H,18,19).
What are the key properties of N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide?
N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide has a molecular weight of 256.28 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 47380307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).