N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide

C19H20N4O2 — CID 122307637

IUPACN-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(Oc2ccc(-n3cccc3)nn2)cc1
InChIInChI=1S/C19H20N4O2/c1-2-3-6-18(24)20-15-7-9-16(10-8-15)25-19-12-11-17(21-22-19)23-13-4-5-14-23/h4-5,7-14H,2-3,6H2,1H3,(H,20,24)
InChIKeyOBENJNYKNCGGAM-UHFFFAOYSA-N
MW336.40 g/mol
LogP4.19
Rot. Bonds7

About N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide

N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide (PubChem CID 122307637) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide.

Molecular Properties

Compound NameN-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide
PubChem CID122307637
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide
SMILESCCCCC(=O)Nc1ccc(Oc2ccc(-n3cccc3)nn2)cc1
InChIInChI=1S/C19H20N4O2/c1-2-3-6-18(24)20-15-7-9-16(10-8-15)25-19-12-11-17(21-22-19)23-13-4-5-14-23/h4-5,7-14H,2-3,6H2,1H3,(H,20,24)
InChIKeyOBENJNYKNCGGAM-UHFFFAOYSA-N
XLogP4.19
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-phenyl-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]propanamide
CID 122307676
4-pentoxy-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]benzamide
CID 122307900
N-[4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]pentanamide
CID 122305368
2-(4-fluorophenyl)-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]acetamide
CID 122307695
2-phenylmethoxy-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]acetamide
CID 122307897
N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide
CID 122307702
1-(3,5-dimethoxyphenyl)-3-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]urea
CID 122307713
N-[4-[6-(2-methylimidazol-1-yl)pyridazin-3-yl]oxyphenyl]-4-phenylbutanamide
CID 122306542
2,6-difluoro-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]benzamide
CID 122307665
4-(1,3-dioxoisoindol-2-yl)-N-[4-(6-imidazol-1-ylpyridazin-3-yl)oxyphenyl]butanamide
CID 122306357
N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]furan-2-carboxamide
CID 122307682
N-[4-[6-(4,5-dimethylimidazol-1-yl)pyridazin-3-yl]oxyphenyl]butanamide
CID 122306878

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide?
The IUPAC name of N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide (CID 122307637) is N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide.
What is the SMILES notation for N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide?
The canonical SMILES for N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide is CCCCC(=O)Nc1ccc(Oc2ccc(-n3cccc3)nn2)cc1.
What is the InChIKey of N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide?
The InChIKey is OBENJNYKNCGGAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-2-3-6-18(24)20-15-7-9-16(10-8-15)25-19-12-11-17(21-22-19)23-13-4-5-14-23/h4-5,7-14H,2-3,6H2,1H3,(H,20,24).
What are the key properties of N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide?
N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide has a molecular weight of 336.40 g/mol, XLogP of 4.19, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide is sourced from PubChem (CID 122307637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).