6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide

C15H17FN4O — CID 62186107

IUPAC6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCCc2ccc(F)cc2)nn1
InChIInChI=1S/C15H17FN4O/c1-2-17-14-8-7-13(19-20-14)15(21)18-10-9-11-3-5-12(16)6-4-11/h3-8H,2,9-10H2,1H3,(H,17,20)(H,18,21)
InChIKeyOKLQCBGDUDCYGD-UHFFFAOYSA-N
MW288.33 g/mol
LogP2.02
Rot. Bonds6

About 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide

6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide (PubChem CID 62186107) has the molecular formula C15H17FN4O and a molecular weight of 288.33 g/mol. Its IUPAC name is 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
PubChem CID62186107
Molecular FormulaC15H17FN4O
Molecular Weight288.33 g/mol
Exact Mass288.14
IUPAC Name6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCCc2ccc(F)cc2)nn1
InChIInChI=1S/C15H17FN4O/c1-2-17-14-8-7-13(19-20-14)15(21)18-10-9-11-3-5-12(16)6-4-11/h3-8H,2,9-10H2,1H3,(H,17,20)(H,18,21)
InChIKeyOKLQCBGDUDCYGD-UHFFFAOYSA-N
XLogP2.02
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(tert-butylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 109122145
6-[(4-fluorophenyl)methylamino]-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109119413
6-[2-(4-fluorophenyl)ethylamino]-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114295
5-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 104639698
6-(2,6-difluoroanilino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 109122201
6-(cyclopropylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 109109833
N-[2-(4-fluorophenyl)ethyl]-6-[2-(3-methoxyphenyl)ethylamino]pyridazine-3-carboxamide
CID 109122136
N,N-diethyl-6-[2-(4-fluorophenyl)ethylamino]pyridazine-3-carboxamide
CID 109122067
6-(2,4-difluoroanilino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 109122195
N-butan-2-yl-6-[2-(4-fluorophenyl)ethylamino]pyridazine-3-carboxamide
CID 109111575
N-(2-phenylethyl)-6-(propylamino)pyridazine-3-carboxamide
CID 62167760
N-[2-(4-fluorophenyl)ethyl]-6-[(5-methyl-1,2-oxazol-3-yl)amino]pyridazine-3-carboxamide
CID 109122203

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide (CID 62186107) is 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide is CCNc1ccc(C(=O)NCCc2ccc(F)cc2)nn1.
What is the InChIKey of 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide?
The InChIKey is OKLQCBGDUDCYGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4O/c1-2-17-14-8-7-13(19-20-14)15(21)18-10-9-11-3-5-12(16)6-4-11/h3-8H,2,9-10H2,1H3,(H,17,20)(H,18,21).
What are the key properties of 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide?
6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide has a molecular weight of 288.33 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide is sourced from PubChem (CID 62186107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).