N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide

C19H14N6O2 — CID 133459492

IUPACN-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(Oc2cccc(-n3ccnn3)c2)nn1
InChIInChI=1S/C19H14N6O2/c26-19(21-14-5-2-1-3-6-14)17-9-10-18(23-22-17)27-16-8-4-7-15(13-16)25-12-11-20-24-25/h1-13H,(H,21,26)
InChIKeyQAEXDHUNWNTUCW-UHFFFAOYSA-N
MW358.36 g/mol
LogP3.10
Rot. Bonds5

About N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide

N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide (PubChem CID 133459492) has the molecular formula C19H14N6O2 and a molecular weight of 358.36 g/mol. Its IUPAC name is N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide
PubChem CID133459492
Molecular FormulaC19H14N6O2
Molecular Weight358.36 g/mol
Exact Mass358.12
IUPAC NameN-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(Oc2cccc(-n3ccnn3)c2)nn1
InChIInChI=1S/C19H14N6O2/c26-19(21-14-5-2-1-3-6-14)17-9-10-18(23-22-17)27-16-8-4-7-15(13-16)25-12-11-20-24-25/h1-13H,(H,21,26)
InChIKeyQAEXDHUNWNTUCW-UHFFFAOYSA-N
XLogP3.10
TPSA94.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6-(4-acetamidophenoxy)-N-phenylpyridazine-3-carboxamide
CID 133313253
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CID 133313243
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CID 82513165
N-phenylpyridazine-3-carboxamide
CID 23633015
2-[3-(triazol-1-yl)phenoxy]-5-(trifluoromethyl)-1,3,4-thiadiazole
CID 167774625
6-(3-bromophenoxy)pyridazine-3-carboxylic acid
CID 60790683
2,2-dimethyl-4-oxo-4-[3-(triazol-1-yl)anilino]butanoic acid
CID 119259712
1-methyl-N-[4-(6-pyrazol-1-ylpyridazin-3-yl)oxyphenyl]triazole-4-carboxamide
CID 122304842
3-(triazol-1-yl)aniline
CID 59199898
2-phenoxy-N-phenylpyridine-4-carboxamide
CID 19093380
(2S)-N-phenyl-2-[3-(tetrazol-1-yl)phenoxy]propanamide
CID 7705759
6,7-bis(2-methoxyethoxy)-N-[3-(triazol-1-yl)phenyl]quinazoline-4-carboxamide
CID 175094594

Frequently Asked Questions

What is the IUPAC name of N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide?
The IUPAC name of N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide (CID 133459492) is N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide.
What is the SMILES notation for N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide?
The canonical SMILES for N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide is O=C(Nc1ccccc1)c1ccc(Oc2cccc(-n3ccnn3)c2)nn1.
What is the InChIKey of N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide?
The InChIKey is QAEXDHUNWNTUCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N6O2/c26-19(21-14-5-2-1-3-6-14)17-9-10-18(23-22-17)27-16-8-4-7-15(13-16)25-12-11-20-24-25/h1-13H,(H,21,26).
What are the key properties of N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide?
N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide has a molecular weight of 358.36 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-6-[3-(triazol-1-yl)phenoxy]pyridazine-3-carboxamide is sourced from PubChem (CID 133459492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).