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

C18H16N4O2 — CID 122307702

IUPACN-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(Oc2ccc(-n3cccc3)nn2)cc1)C1CC1
InChIInChI=1S/C18H16N4O2/c23-18(13-3-4-13)19-14-5-7-15(8-6-14)24-17-10-9-16(20-21-17)22-11-1-2-12-22/h1-2,5-13H,3-4H2,(H,19,23)
InChIKeyNKXQEOFJWFUDEM-UHFFFAOYSA-N
MW320.35 g/mol
LogP3.41
Rot. Bonds5

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

N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide (PubChem CID 122307702) has the molecular formula C18H16N4O2 and a molecular weight of 320.35 g/mol. Its IUPAC name is N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide
PubChem CID122307702
Molecular FormulaC18H16N4O2
Molecular Weight320.35 g/mol
Exact Mass320.13
IUPAC NameN-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(Oc2ccc(-n3cccc3)nn2)cc1)C1CC1
InChIInChI=1S/C18H16N4O2/c23-18(13-3-4-13)19-14-5-7-15(8-6-14)24-17-10-9-16(20-21-17)22-11-1-2-12-22/h1-2,5-13H,3-4H2,(H,19,23)
InChIKeyNKXQEOFJWFUDEM-UHFFFAOYSA-N
XLogP3.41
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(6-pyrazol-1-ylpyridazin-3-yl)oxyphenyl]cyclobutanecarboxamide
CID 122304831
2,6-difluoro-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]benzamide
CID 122307665
N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]pentanamide
CID 122307637
N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]furan-2-carboxamide
CID 122307682
3-phenyl-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]propanamide
CID 122307676
1-(3,5-dimethoxyphenyl)-3-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]urea
CID 122307713
3,5-dinitro-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]benzamide
CID 122308001
2-(4-fluorophenyl)-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]acetamide
CID 122307695
N-[4-(6-pyrazol-1-ylpyridazin-3-yl)oxyphenyl]oxolane-3-carboxamide
CID 122304865
4-cyano-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]benzamide
CID 122307861
2-phenylmethoxy-N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]acetamide
CID 122307897
1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]urea
CID 122307737

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide (CID 122307702) is N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide is O=C(Nc1ccc(Oc2ccc(-n3cccc3)nn2)cc1)C1CC1.
What is the InChIKey of N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide?
The InChIKey is NKXQEOFJWFUDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2/c23-18(13-3-4-13)19-14-5-7-15(8-6-14)24-17-10-9-16(20-21-17)22-11-1-2-12-22/h1-2,5-13H,3-4H2,(H,19,23).
What are the key properties of N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide?
N-[4-(6-pyrrol-1-ylpyridazin-3-yl)oxyphenyl]cyclopropanecarboxamide has a molecular weight of 320.35 g/mol, XLogP of 3.41, 5 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]cyclopropanecarboxamide is sourced from PubChem (CID 122307702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).