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

C16H16FN3O — CID 113200165

IUPAC6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(C2CC2)nn1
InChIInChI=1S/C16H16FN3O/c17-13-4-2-1-3-11(13)9-10-18-16(21)15-8-7-14(19-20-15)12-5-6-12/h1-4,7-8,12H,5-6,9-10H2,(H,18,21)
InChIKeyIYYZGDMQYGZKNS-UHFFFAOYSA-N
MW285.32 g/mol
LogP2.47
Rot. Bonds5

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

6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide (PubChem CID 113200165) has the molecular formula C16H16FN3O and a molecular weight of 285.32 g/mol. Its IUPAC name is 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide
PubChem CID113200165
Molecular FormulaC16H16FN3O
Molecular Weight285.32 g/mol
Exact Mass285.13
IUPAC Name6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(C2CC2)nn1
InChIInChI=1S/C16H16FN3O/c17-13-4-2-1-3-11(13)9-10-18-16(21)15-8-7-14(19-20-15)12-5-6-12/h1-4,7-8,12H,5-6,9-10H2,(H,18,21)
InChIKeyIYYZGDMQYGZKNS-UHFFFAOYSA-N
XLogP2.47
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-cyclopropyl-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide
CID 113200156
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CID 109113743
N-[2-(2-fluorophenyl)ethyl]-6-(prop-2-enylamino)pyridazine-3-carboxamide
CID 109110225
6-[2-(4-chlorophenyl)ethylamino]-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 109121995
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
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2-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazo[1,2-b]pyridazine-6-carboxamide
CID 154854059
4-N-cyclopropyl-1-N-[2-(2-fluorophenyl)ethyl]benzene-1,4-dicarboxamide
CID 109043298
N-[2-(2-fluorophenyl)ethyl]-1,2-oxazole-3-carboxamide
CID 110693729
N-[2-(2-fluorophenyl)ethyl]-5-(2-phenylethylamino)pyridine-2-carboxamide
CID 109191848
3-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole-6-carboxamide
CID 110385380
N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109122026
6-(2,4-dimethoxyanilino)-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 109122035

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide (CID 113200165) is 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide is O=C(NCCc1ccccc1F)c1ccc(C2CC2)nn1.
What is the InChIKey of 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide?
The InChIKey is IYYZGDMQYGZKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O/c17-13-4-2-1-3-11(13)9-10-18-16(21)15-8-7-14(19-20-15)12-5-6-12/h1-4,7-8,12H,5-6,9-10H2,(H,18,21).
What are the key properties of 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide?
6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide has a molecular weight of 285.32 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide is sourced from PubChem (CID 113200165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).