N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide

C18H13FN4O — CID 97362048

IUPACN-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1ccn(-c2ccc3ccccn23)n1
InChIInChI=1S/C18H13FN4O/c19-13-4-3-5-14(12-13)20-18(24)16-9-11-23(21-16)17-8-7-15-6-1-2-10-22(15)17/h1-12H,(H,20,24)
InChIKeyXQXIXGCLZWSZHR-UHFFFAOYSA-N
MW320.33 g/mol
LogP3.52
Rot. Bonds3

About N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide

N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide (PubChem CID 97362048) has the molecular formula C18H13FN4O and a molecular weight of 320.33 g/mol. Its IUPAC name is N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide
PubChem CID97362048
Molecular FormulaC18H13FN4O
Molecular Weight320.33 g/mol
Exact Mass320.11
IUPAC NameN-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1ccn(-c2ccc3ccccn23)n1
InChIInChI=1S/C18H13FN4O/c19-13-4-3-5-14(12-13)20-18(24)16-9-11-23(21-16)17-8-7-15-6-1-2-10-22(15)17/h1-12H,(H,20,24)
InChIKeyXQXIXGCLZWSZHR-UHFFFAOYSA-N
XLogP3.52
TPSA51.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.33
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[6-(3-fluorophenyl)indolizin-3-yl]-N-pyridin-3-ylpyrazole-3-carboxamide
CID 97447411
1-[6-(3-fluorophenyl)indolizin-3-yl]-N-(6-methyl-3-pyridinyl)pyrazole-3-carboxamide
CID 97362146
1-(3-fluorophenyl)-N-[4-(phenylcarbamoylamino)phenyl]pyrazole-3-carboxamide
CID 47882488
N-(3-acetamidophenyl)-1-(4-fluorophenyl)pyrazole-3-carboxamide
CID 38764433
1-(2-fluorophenyl)-N-[3-(hydroxymethyl)phenyl]pyrazole-3-carboxamide
CID 110910871
1-[2-(3-fluoroanilino)-2-oxoethyl]-N-(3-fluorophenyl)pyrazole-3-carboxamide
CID 29098002
1-indolizin-3-yl-N-(3-methoxypropyl)pyrazole-3-carboxamide
CID 97362064
N-[3-[(dimethylamino)methyl]phenyl]-1-(2-fluorophenyl)pyrazole-3-carboxamide
CID 86980854
1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(6-methyl-3-pyridinyl)pyrazole-3-carboxamide
CID 97362163
3-N,5-N-bis(3-fluorophenyl)-1-methylpyrazole-3,5-dicarboxamide
CID 29097363
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-1-(3-fluorophenyl)pyrazole-3-carboxamide
CID 49168620
2,3,5,6-tetrafluoro-1-N,4-N-bis(3-fluorophenyl)benzene-1,4-dicarboxamide
CID 3094065

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide (CID 97362048) is N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide is O=C(Nc1cccc(F)c1)c1ccn(-c2ccc3ccccn23)n1.
What is the InChIKey of N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide?
The InChIKey is XQXIXGCLZWSZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN4O/c19-13-4-3-5-14(12-13)20-18(24)16-9-11-23(21-16)17-8-7-15-6-1-2-10-22(15)17/h1-12H,(H,20,24).
What are the key properties of N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide?
N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide has a molecular weight of 320.33 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-1-indolizin-3-ylpyrazole-3-carboxamide is sourced from PubChem (CID 97362048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).