6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide

C14H15FN4O2 — CID 109114000

IUPAC6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
SMILESCOCCNC(=O)c1ccc(Nc2ccccc2F)nn1
InChIInChI=1S/C14H15FN4O2/c1-21-9-8-16-14(20)12-6-7-13(19-18-12)17-11-5-3-2-4-10(11)15/h2-7H,8-9H2,1H3,(H,16,20)(H,17,19)
InChIKeyRNPMDQAIOGXSNS-UHFFFAOYSA-N
MW290.30 g/mol
LogP1.74
Rot. Bonds6

About 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide

6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide (PubChem CID 109114000) has the molecular formula C14H15FN4O2 and a molecular weight of 290.30 g/mol. Its IUPAC name is 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
PubChem CID109114000
Molecular FormulaC14H15FN4O2
Molecular Weight290.30 g/mol
Exact Mass290.12
IUPAC Name6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
SMILESCOCCNC(=O)c1ccc(Nc2ccccc2F)nn1
InChIInChI=1S/C14H15FN4O2/c1-21-9-8-16-14(20)12-6-7-13(19-18-12)17-11-5-3-2-4-10(11)15/h2-7H,8-9H2,1H3,(H,16,20)(H,17,19)
InChIKeyRNPMDQAIOGXSNS-UHFFFAOYSA-N
XLogP1.74
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.30
LogP ≤ 51.74
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

N-[2-(dimethylamino)ethyl]-6-(2-fluoroanilino)pyridazine-3-carboxamide
CID 109115424
N-[3-(dimethylamino)propyl]-6-(2-fluoroanilino)pyridazine-3-carboxamide
CID 109116042
5-(2-fluoroanilino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109183927
6-(3-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
CID 109114048
6-(4-chloro-2-methylanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
CID 109114007
N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109122026
6-(2-fluoroanilino)-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109121435
N-[(4-chlorophenyl)methyl]-6-(2-fluoroanilino)pyridazine-3-carboxamide
CID 109119919
6-(2,6-dichloroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
CID 109114069
6-(2-fluoroanilino)-N-(4-methoxyphenyl)pyridazine-3-carboxamide
CID 109128356
N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyethylamino)pyridazine-3-carboxamide
CID 109113743
N,N-diethyl-6-(2-fluoroanilino)pyridazine-3-carboxamide
CID 109124434

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide (CID 109114000) is 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide is COCCNC(=O)c1ccc(Nc2ccccc2F)nn1.
What is the InChIKey of 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide?
The InChIKey is RNPMDQAIOGXSNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN4O2/c1-21-9-8-16-14(20)12-6-7-13(19-18-12)17-11-5-3-2-4-10(11)15/h2-7H,8-9H2,1H3,(H,16,20)(H,17,19).
What are the key properties of 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide?
6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide has a molecular weight of 290.30 g/mol, XLogP of 1.74, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109114000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).