6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide

C20H17N3O2 — CID 113200298

IUPAC6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1Oc1ccccc1)c1ccc(C2CC2)nn1
InChIInChI=1S/C20H17N3O2/c24-20(18-13-12-16(22-23-18)14-10-11-14)21-17-8-4-5-9-19(17)25-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,21,24)
InChIKeyQYMATXOFKHXVEG-UHFFFAOYSA-N
MW331.38 g/mol
LogP4.40
Rot. Bonds5

About 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide

6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide (PubChem CID 113200298) has the molecular formula C20H17N3O2 and a molecular weight of 331.38 g/mol. Its IUPAC name is 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide
PubChem CID113200298
Molecular FormulaC20H17N3O2
Molecular Weight331.38 g/mol
Exact Mass331.13
IUPAC Name6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1Oc1ccccc1)c1ccc(C2CC2)nn1
InChIInChI=1S/C20H17N3O2/c24-20(18-13-12-16(22-23-18)14-10-11-14)21-17-8-4-5-9-19(17)25-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,21,24)
InChIKeyQYMATXOFKHXVEG-UHFFFAOYSA-N
XLogP4.40
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide
CID 110705367
2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-(2-phenoxyphenyl)acetamide
CID 122278540
N-cyclopentyl-6-(2-phenoxyanilino)pyridazine-3-carboxamide
CID 109112427
(2S)-N-(2-phenoxyphenyl)pyrrolidin-1-ium-2-carboxamide
CID 6941294
6-cyclopropyl-N-(2,3,4-trifluorophenyl)pyridazine-3-carboxamide
CID 113200317
N-(2-phenoxyphenyl)-5-(prop-2-enylamino)pyridine-2-carboxamide
CID 109180597
5-cyclopropyl-N-[2-(4-methylphenoxy)phenyl]-1,2-oxazole-3-carboxamide
CID 38507620
2-(cyclopentylamino)-N-(2-phenoxyphenyl)pyrimidine-4-carboxamide
CID 109298011
2-methyl-N-(2-phenoxyphenyl)-1,3-oxazole-4-carboxamide
CID 30402981
6-cyclopropyl-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide
CID 113200156
5-cyano-6-methyl-N-(2-phenoxyphenyl)pyridine-2-carboxamide
CID 39090146
5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide
CID 109278397

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide (CID 113200298) is 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide is O=C(Nc1ccccc1Oc1ccccc1)c1ccc(C2CC2)nn1.
What is the InChIKey of 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide?
The InChIKey is QYMATXOFKHXVEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2/c24-20(18-13-12-16(22-23-18)14-10-11-14)21-17-8-4-5-9-19(17)25-15-6-2-1-3-7-15/h1-9,12-14H,10-11H2,(H,21,24).
What are the key properties of 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide?
6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide has a molecular weight of 331.38 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 113200298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).