N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide

C15H15FN4O2 — CID 90638455

IUPACN-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCC(Oc2cccnn2)C1
InChIInChI=1S/C15H15FN4O2/c16-12-4-1-2-5-13(12)18-15(21)20-9-7-11(10-20)22-14-6-3-8-17-19-14/h1-6,8,11H,7,9-10H2,(H,18,21)
InChIKeyJARJIOMNOOSWTE-UHFFFAOYSA-N
MW302.31 g/mol
LogP2.30
Rot. Bonds3

About N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide

N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide (PubChem CID 90638455) has the molecular formula C15H15FN4O2 and a molecular weight of 302.31 g/mol. Its IUPAC name is N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
PubChem CID90638455
Molecular FormulaC15H15FN4O2
Molecular Weight302.31 g/mol
Exact Mass302.12
IUPAC NameN-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCC(Oc2cccnn2)C1
InChIInChI=1S/C15H15FN4O2/c16-12-4-1-2-5-13(12)18-15(21)20-9-7-11(10-20)22-14-6-3-8-17-19-14/h1-6,8,11H,7,9-10H2,(H,18,21)
InChIKeyJARJIOMNOOSWTE-UHFFFAOYSA-N
XLogP2.30
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.31
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-difluorophenyl)-4-pyridazin-3-yloxypiperidine-1-carboxamide
CID 90559382
3-pyridazin-3-yloxy-N-[4-(trifluoromethyl)phenyl]pyrrolidine-1-carboxamide
CID 90638470
1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
CID 90638196
N-propan-2-yl-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
CID 90638477
2,2,2-trifluoro-1-(3-pyridazin-3-yloxypyrrolidin-1-yl)ethanone
CID 159511918
N-cycloheptyl-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
CID 90638486
N-(2-fluorophenyl)-3-pyrimidin-2-yloxypiperidine-1-carboxamide
CID 122257527
N-(2-fluorophenyl)-3-[[3-(piperidine-1-carbonyl)-2-pyridinyl]oxy]pyrrolidine-1-carboxamide
CID 91914043
2-[1-[(2-fluorophenyl)carbamoyl]pyrrolidin-3-yl]oxy-N,N-dimethylpyridine-3-carboxamide
CID 91913980
(2R)-2-hydroxy-2-phenyl-1-[(3S)-3-pyridazin-3-yloxypyrrolidin-1-yl]ethanone
CID 100622951
N-(2-methoxyethyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
CID 91627281
3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide
CID 121197683

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide (CID 90638455) is N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide is O=C(Nc1ccccc1F)N1CCC(Oc2cccnn2)C1.
What is the InChIKey of N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide?
The InChIKey is JARJIOMNOOSWTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN4O2/c16-12-4-1-2-5-13(12)18-15(21)20-9-7-11(10-20)22-14-6-3-8-17-19-14/h1-6,8,11H,7,9-10H2,(H,18,21).
What are the key properties of N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide?
N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide has a molecular weight of 302.31 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide is sourced from PubChem (CID 90638455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).