4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide

C19H14FN5O3 — CID 11981210

IUPAC4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide
SMILESNC(=O)c1cc(COc2nnc(Nc3ccc(F)cc3)c3ccoc23)ccn1
InChIInChI=1S/C19H14FN5O3/c20-12-1-3-13(4-2-12)23-18-14-6-8-27-16(14)19(25-24-18)28-10-11-5-7-22-15(9-11)17(21)26/h1-9H,10H2,(H2,21,26)(H,23,24)
InChIKeyLKRWPSCLQNUEIO-UHFFFAOYSA-N
MW379.35 g/mol
LogP3.18
Rot. Bonds6

About 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide

4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide (PubChem CID 11981210) has the molecular formula C19H14FN5O3 and a molecular weight of 379.35 g/mol. Its IUPAC name is 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide
PubChem CID11981210
Molecular FormulaC19H14FN5O3
Molecular Weight379.35 g/mol
Exact Mass379.11
IUPAC Name4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide
SMILESNC(=O)c1cc(COc2nnc(Nc3ccc(F)cc3)c3ccoc23)ccn1
InChIInChI=1S/C19H14FN5O3/c20-12-1-3-13(4-2-12)23-18-14-6-8-27-16(14)19(25-24-18)28-10-11-5-7-22-15(9-11)17(21)26/h1-9H,10H2,(H2,21,26)(H,23,24)
InChIKeyLKRWPSCLQNUEIO-UHFFFAOYSA-N
XLogP3.18
TPSA116.16 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.35
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide with MolForge

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Related Compounds

Telatinib
CID 9808844
Telatinib Mesylate
CID 9870815
4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]-N-methylpyridine-2-carboxamide
CID 9800715
N-methyl-4-[[4-[4-(trifluoromethoxy)anilino]furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide
CID 9847008
4-[[4-(3,4-difluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]-N-methylpyridine-2-carboxamide
CID 9866305
N-methyl-4-[[4-[4-(trifluoromethyl)anilino]furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide
CID 9889604
4-[[4-(3-chloro-4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]-N-methylpyridine-2-carboxamide
CID 9910417
4-[2-[4-(3,4-Difluoroanilino)furo[2,3-d]pyridazin-7-yl]oxyethyl]pyridine-2-carboxamide
CID 91175383
4-[2-[4-(3-Chloro-4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxyethyl]pyridine-2-carboxamide
CID 91438773
4-[2-[4-(4-Fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxyethyl]pyridine-2-carboxamide
CID 91555270
N'-(7-benzylfuro[2,3-d]pyridazin-4-yl)-N-[5-(trifluoromethyl)pyridin-2-yl]ethane-1,2-diamine
CID 135268311
4-Methyl-7-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]furo[2,3-d]pyridazine
CID 145473915

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide?
The IUPAC name of 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide (CID 11981210) is 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide is NC(=O)c1cc(COc2nnc(Nc3ccc(F)cc3)c3ccoc23)ccn1.
What is the InChIKey of 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide?
The InChIKey is LKRWPSCLQNUEIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN5O3/c20-12-1-3-13(4-2-12)23-18-14-6-8-27-16(14)19(25-24-18)28-10-11-5-7-22-15(9-11)17(21)26/h1-9H,10H2,(H2,21,26)(H,23,24).
What are the key properties of 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide?
4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide has a molecular weight of 379.35 g/mol, XLogP of 3.18, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(4-fluoroanilino)furo[2,3-d]pyridazin-7-yl]oxymethyl]pyridine-2-carboxamide is sourced from PubChem (CID 11981210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).