6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide

C16H20N4O2 — CID 133445922

IUPAC6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide
SMILESCCOCCN(C)c1ccc(C(=O)Nc2ccccc2)nn1
InChIInChI=1S/C16H20N4O2/c1-3-22-12-11-20(2)15-10-9-14(18-19-15)16(21)17-13-7-5-4-6-8-13/h4-10H,3,11-12H2,1-2H3,(H,17,21)
InChIKeySVSIMKNTLPSLEA-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.20
Rot. Bonds7

About 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide

6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide (PubChem CID 133445922) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide
PubChem CID133445922
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide
SMILESCCOCCN(C)c1ccc(C(=O)Nc2ccccc2)nn1
InChIInChI=1S/C16H20N4O2/c1-3-22-12-11-20(2)15-10-9-14(18-19-15)16(21)17-13-7-5-4-6-8-13/h4-10H,3,11-12H2,1-2H3,(H,17,21)
InChIKeySVSIMKNTLPSLEA-UHFFFAOYSA-N
XLogP2.20
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[methyl-[2-(2-methylphenoxy)ethyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133313505
6-[methyl-[(2-methylphenyl)methyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133313290
N-(4-ethoxyphenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide
CID 109128038
6-[butyl(methyl)amino]-N-(4-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 109125585
6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide
CID 109128041
6-[bis(2-ethoxyethyl)amino]pyridazine-3-carboxylic acid
CID 82956314
6-[butyl(methyl)amino]-N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109125615
6-[butyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109125613
6-[benzyl(methyl)amino]-N-[4-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109119018
6-[ethyl-[(4-methoxyphenyl)methyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133384179
6-[benzyl(methyl)amino]-N-(3,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109119015
N-benzyl-6-[butyl(methyl)amino]pyridazine-3-carboxamide
CID 109117888

Frequently Asked Questions

What is the IUPAC name of 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide?
The IUPAC name of 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide (CID 133445922) is 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide?
The canonical SMILES for 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide is CCOCCN(C)c1ccc(C(=O)Nc2ccccc2)nn1.
What is the InChIKey of 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide?
The InChIKey is SVSIMKNTLPSLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-3-22-12-11-20(2)15-10-9-14(18-19-15)16(21)17-13-7-5-4-6-8-13/h4-10H,3,11-12H2,1-2H3,(H,17,21).
What are the key properties of 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide?
6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 133445922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).