6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine

C18H15N3O — CID 170619902

IUPAC6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine
SMILESC=Cc1cc(Nc2ccc(Oc3ccccc3)cc2)cnn1
InChIInChI=1S/C18H15N3O/c1-2-14-12-16(13-19-21-14)20-15-8-10-18(11-9-15)22-17-6-4-3-5-7-17/h2-13H,1H2,(H,20,21)
InChIKeyBFSWQPIKPGOZPM-UHFFFAOYSA-N
MW289.34 g/mol
LogP4.66
Rot. Bonds5

About 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine

6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine (PubChem CID 170619902) has the molecular formula C18H15N3O and a molecular weight of 289.34 g/mol. Its IUPAC name is 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine.

Molecular Properties

Compound Name6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine
PubChem CID170619902
Molecular FormulaC18H15N3O
Molecular Weight289.34 g/mol
Exact Mass289.12
IUPAC Name6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine
SMILESC=Cc1cc(Nc2ccc(Oc3ccccc3)cc2)cnn1
InChIInChI=1S/C18H15N3O/c1-2-14-12-16(13-19-21-14)20-15-8-10-18(11-9-15)22-17-6-4-3-5-7-17/h2-13H,1H2,(H,20,21)
InChIKeyBFSWQPIKPGOZPM-UHFFFAOYSA-N
XLogP4.66
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-N,4-N-bis[4-(4-ethenylphenoxy)phenyl]benzene-1,4-diamine
CID 139419448
5-N-[4-(4-chlorophenoxy)phenyl]pyridazine-3,5-diamine
CID 70683160
3-N-(4-methoxyphenyl)-5-N-(4-phenoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112967421
5-N-(3,4-difluorophenyl)-3-N-(4-phenoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112969056
3-N-(2-methylpropyl)-5-N-(4-phenoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112940614
4-[5-(4-phenoxyanilino)-1,2,4-triazin-3-yl]piperazine-1-carbaldehyde
CID 112946795
5-N-(4-phenoxyphenyl)-3-N,3-N-dipropyl-1,2,4-triazine-3,5-diamine
CID 112960998
5-N-butan-2-yl-3-N-(4-phenoxyphenyl)-1,2,4-triazine-3,5-diamine
CID 112940808
N-methyl-5-(4-phenoxyanilino)-N-phenylpyridine-3-carboxamide
CID 109242250
N,N-diethyl-5-(4-phenoxyanilino)pyridine-3-carboxamide
CID 109238844
1,3,5-tris[4-(4-phenoxyphenoxy)phenoxy]benzene
CID 167430627
4-ethenyl-N-phenylaniline
CID 21478062

Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine?
The IUPAC name of 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine (CID 170619902) is 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine.
What is the SMILES notation for 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine?
The canonical SMILES for 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine is C=Cc1cc(Nc2ccc(Oc3ccccc3)cc2)cnn1.
What is the InChIKey of 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine?
The InChIKey is BFSWQPIKPGOZPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O/c1-2-14-12-16(13-19-21-14)20-15-8-10-18(11-9-15)22-17-6-4-3-5-7-17/h2-13H,1H2,(H,20,21).
What are the key properties of 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine?
6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine has a molecular weight of 289.34 g/mol, XLogP of 4.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-N-(4-phenoxyphenyl)pyridazin-4-amine is sourced from PubChem (CID 170619902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).