6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide

C19H18N4O2 — CID 133313334

IUPAC6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(NCCOc2ccccc2)nn1
InChIInChI=1S/C19H18N4O2/c24-19(21-15-7-3-1-4-8-15)17-11-12-18(23-22-17)20-13-14-25-16-9-5-2-6-10-16/h1-12H,13-14H2,(H,20,23)(H,21,24)
InChIKeyMIDITVYZRIGWFG-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.22
Rot. Bonds7

About 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide

6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide (PubChem CID 133313334) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide
PubChem CID133313334
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(NCCOc2ccccc2)nn1
InChIInChI=1S/C19H18N4O2/c24-19(21-15-7-3-1-4-8-15)17-11-12-18(23-22-17)20-13-14-25-16-9-5-2-6-10-16/h1-12H,13-14H2,(H,20,23)(H,21,24)
InChIKeyMIDITVYZRIGWFG-UHFFFAOYSA-N
XLogP3.22
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(3-methoxypropylamino)-N-(4-phenylmethoxyphenyl)pyridazine-3-carboxamide
CID 109114229
6-(3-methylbutylamino)-N-phenylpyridazine-3-carboxamide
CID 109125155
6-(methylamino)-N-(2-phenoxyethyl)pyridazine-3-carboxamide
CID 62179050
6-[2-(4-methoxyphenoxy)ethylamino]-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109121641
6-(2-methoxyethylamino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide
CID 109113837
N-methyl-6-(2-pyridin-3-yloxyethylamino)pyridazine-3-carboxamide
CID 133339567
N-(4-tert-butylphenyl)-6-(3-methoxypropylamino)pyridazine-3-carboxamide
CID 109114181
N-(4-phenylmethoxyphenyl)-6-(prop-2-enylamino)pyridazine-3-carboxamide
CID 109110344
N-(4-ethylphenyl)-6-(3-methoxypropylamino)pyridazine-3-carboxamide
CID 109114172
6-[[2-(dimethylamino)-2-phenylethyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133313257
6-(1-methoxypropan-2-ylamino)-N-phenylpyridazine-3-carboxamide
CID 133313240
6-(3-methoxypropylamino)-N-(4-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 109114176

Frequently Asked Questions

What is the IUPAC name of 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide?
The IUPAC name of 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide (CID 133313334) is 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide.
What is the SMILES notation for 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide?
The canonical SMILES for 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide is O=C(Nc1ccccc1)c1ccc(NCCOc2ccccc2)nn1.
What is the InChIKey of 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide?
The InChIKey is MIDITVYZRIGWFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c24-19(21-15-7-3-1-4-8-15)17-11-12-18(23-22-17)20-13-14-25-16-9-5-2-6-10-16/h1-12H,13-14H2,(H,20,23)(H,21,24).
What are the key properties of 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide?
6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.22, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-phenoxyethylamino)-N-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 133313334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).