2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide

C16H19ClN4O — CID 113043990

IUPAC2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide
SMILESCCN(CC)c1ccc(NC(=O)Cc2ccc(Cl)cc2)nn1
InChIInChI=1S/C16H19ClN4O/c1-3-21(4-2)15-10-9-14(19-20-15)18-16(22)11-12-5-7-13(17)8-6-12/h5-10H,3-4,11H2,1-2H3,(H,18,19,22)
InChIKeyQSQPRBIFJYQFLU-UHFFFAOYSA-N
MW318.81 g/mol
LogP3.16
Rot. Bonds6

About 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide

2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide (PubChem CID 113043990) has the molecular formula C16H19ClN4O and a molecular weight of 318.81 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide
PubChem CID113043990
Molecular FormulaC16H19ClN4O
Molecular Weight318.81 g/mol
Exact Mass318.12
IUPAC Name2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide
SMILESCCN(CC)c1ccc(NC(=O)Cc2ccc(Cl)cc2)nn1
InChIInChI=1S/C16H19ClN4O/c1-3-21(4-2)15-10-9-14(19-20-15)18-16(22)11-12-5-7-13(17)8-6-12/h5-10H,3-4,11H2,1-2H3,(H,18,19,22)
InChIKeyQSQPRBIFJYQFLU-UHFFFAOYSA-N
XLogP3.16
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.81
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenyl)-N-[6-(dipropylamino)pyridazin-3-yl]acetamide
CID 113045158
2-(4-bromophenyl)-N-[6-(dipropylamino)pyridazin-3-yl]acetamide
CID 113045186
2-(4-chlorophenyl)-N-[6-(propan-2-ylamino)pyridazin-3-yl]acetamide
CID 113037948
2-(4-chlorophenyl)-N-[6-[2-(dimethylamino)ethylamino]pyridazin-3-yl]acetamide
CID 113039920
N-[(4-chlorophenyl)methyl]-6-(diethylamino)pyridazine-3-carboxamide
CID 109119900
N-[6-[benzyl(ethyl)amino]pyridazin-3-yl]-2-chlorobenzamide
CID 113041914
2-(4-chlorophenyl)-N-[6-(cyclopropylamino)pyridazin-3-yl]acetamide
CID 113038076
N-[6-(N-ethylanilino)pyridazin-3-yl]-2-(4-methylphenyl)acetamide
CID 113046832
2-(4-chlorophenyl)-N-[4-[(6-methylpyridazin-3-yl)amino]phenyl]acetamide
CID 56919650
2-(4-chlorophenyl)-N-[[4-(diethylamino)phenyl]methyl]acetamide
CID 100610001
N-(5-amino-6-methyl-2-pyridinyl)-2-(4-chlorophenyl)acetamide
CID 82330943
N-[6-(diethylamino)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113014581

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide (CID 113043990) is 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide is CCN(CC)c1ccc(NC(=O)Cc2ccc(Cl)cc2)nn1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide?
The InChIKey is QSQPRBIFJYQFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN4O/c1-3-21(4-2)15-10-9-14(19-20-15)18-16(22)11-12-5-7-13(17)8-6-12/h5-10H,3-4,11H2,1-2H3,(H,18,19,22).
What are the key properties of 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide?
2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide has a molecular weight of 318.81 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[6-(diethylamino)pyridazin-3-yl]acetamide is sourced from PubChem (CID 113043990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).