N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide

C19H18FN5O2 — CID 113043760

IUPACN-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide
SMILESO=C(Nc1ccc(N2CCN(c3ccccc3F)CC2)nn1)c1ccco1
InChIInChI=1S/C19H18FN5O2/c20-14-4-1-2-5-15(14)24-9-11-25(12-10-24)18-8-7-17(22-23-18)21-19(26)16-6-3-13-27-16/h1-8,13H,9-12H2,(H,21,22,26)
InChIKeySJYQSTJNOBZPEB-UHFFFAOYSA-N
MW367.38 g/mol
LogP2.79
Rot. Bonds4

About N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide

N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide (PubChem CID 113043760) has the molecular formula C19H18FN5O2 and a molecular weight of 367.38 g/mol. Its IUPAC name is N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide
PubChem CID113043760
Molecular FormulaC19H18FN5O2
Molecular Weight367.38 g/mol
Exact Mass367.14
IUPAC NameN-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide
SMILESO=C(Nc1ccc(N2CCN(c3ccccc3F)CC2)nn1)c1ccco1
InChIInChI=1S/C19H18FN5O2/c20-14-4-1-2-5-15(14)24-9-11-25(12-10-24)18-8-7-17(22-23-18)21-19(26)16-6-3-13-27-16/h1-8,13H,9-12H2,(H,21,22,26)
InChIKeySJYQSTJNOBZPEB-UHFFFAOYSA-N
XLogP2.79
TPSA74.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.38
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-(4-acetylpiperazin-1-yl)pyridazin-3-yl]furan-2-carboxamide
CID 113040547
N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]acetamide
CID 113043749
N-[2-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl]furan-2-carboxamide
CID 6460180
N-[4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1,3-oxazol-2-yl]furan-2-carboxamide
CID 90515113
N-[6-[4-(furan-2-carbonyl)piperazin-1-yl]pyridazin-3-yl]acetamide
CID 113043806
2-fluoro-N-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]benzamide
CID 113040220
3-(dimethylsulfamoylamino)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazine
CID 113043785
2-fluoro-N-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]benzamide
CID 113039196
6-[4-(2-fluorophenyl)piperazin-1-yl]-N-prop-2-enylpyridazine-3-carboxamide
CID 109110446
N-[3-[[[C-[4-(2-fluorophenyl)piperazin-1-yl]-N-methylcarbonimidoyl]amino]methyl]phenyl]furan-2-carboxamide;hydroiodide
CID 111148340
N-[6-(2,4-difluoroanilino)pyridazin-3-yl]furan-2-carboxamide
CID 113050490
N-[6-[4-(2-methoxyphenyl)piperazin-1-yl]pyridazin-3-yl]benzamide
CID 113043687

Frequently Asked Questions

What is the IUPAC name of N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide?
The IUPAC name of N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide (CID 113043760) is N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide.
What is the SMILES notation for N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide?
The canonical SMILES for N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide is O=C(Nc1ccc(N2CCN(c3ccccc3F)CC2)nn1)c1ccco1.
What is the InChIKey of N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide?
The InChIKey is SJYQSTJNOBZPEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN5O2/c20-14-4-1-2-5-15(14)24-9-11-25(12-10-24)18-8-7-17(22-23-18)21-19(26)16-6-3-13-27-16/h1-8,13H,9-12H2,(H,21,22,26).
What are the key properties of N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide?
N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide has a molecular weight of 367.38 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]furan-2-carboxamide is sourced from PubChem (CID 113043760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).