6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide

C17H18F2N4O — CID 109112976

IUPAC6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc(NC2CCCCC2)nn1
InChIInChI=1S/C17H18F2N4O/c18-13-7-6-12(10-14(13)19)21-17(24)15-8-9-16(23-22-15)20-11-4-2-1-3-5-11/h6-11H,1-5H2,(H,20,23)(H,21,24)
InChIKeyAZRNJUDQMUVKIY-UHFFFAOYSA-N
MW332.35 g/mol
LogP3.75
Rot. Bonds4

About 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide

6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide (PubChem CID 109112976) has the molecular formula C17H18F2N4O and a molecular weight of 332.35 g/mol. Its IUPAC name is 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide
PubChem CID109112976
Molecular FormulaC17H18F2N4O
Molecular Weight332.35 g/mol
Exact Mass332.14
IUPAC Name6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc(NC2CCCCC2)nn1
InChIInChI=1S/C17H18F2N4O/c18-13-7-6-12(10-14(13)19)21-17(24)15-8-9-16(23-22-15)20-11-4-2-1-3-5-11/h6-11H,1-5H2,(H,20,23)(H,21,24)
InChIKeyAZRNJUDQMUVKIY-UHFFFAOYSA-N
XLogP3.75
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.35
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chlorophenyl)-6-(cyclopentylamino)pyridazine-3-carboxamide
CID 109112186
6-(cycloheptylamino)-N-phenylpyridazine-3-carboxamide
CID 109124960
4-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 109205065
N-(3-bromo-4-methylphenyl)-6-(cyclopentylamino)pyridazine-3-carboxamide
CID 109112196
6-(cyclohexylamino)-N-(2,4-dichlorophenyl)pyridazine-3-carboxamide
CID 109112961
N-cyclohexyl-6-(cyclohexylamino)pyridazine-3-carboxamide
CID 109112809
6-(cycloheptylamino)-N-cyclopropylpyridazine-3-carboxamide
CID 109110063
N-cyclopentyl-6-(cyclopentylamino)pyridazine-3-carboxamide
CID 109112077
N-(5-chloro-2-methoxyphenyl)-6-(cyclohexylamino)pyridazine-3-carboxamide
CID 109112915
N-(3-acetamidophenyl)-6-(cyclopropylamino)pyridazine-3-carboxamide
CID 109109935
6-(3,4-difluoroanilino)-N-(4-fluorophenyl)pyridazine-3-carboxamide
CID 109128571
6-(cyclopropylamino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
CID 109109890

Frequently Asked Questions

What is the IUPAC name of 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide (CID 109112976) is 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide is O=C(Nc1ccc(F)c(F)c1)c1ccc(NC2CCCCC2)nn1.
What is the InChIKey of 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide?
The InChIKey is AZRNJUDQMUVKIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2N4O/c18-13-7-6-12(10-14(13)19)21-17(24)15-8-9-16(23-22-15)20-11-4-2-1-3-5-11/h6-11H,1-5H2,(H,20,23)(H,21,24).
What are the key properties of 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide?
6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide has a molecular weight of 332.35 g/mol, XLogP of 3.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclohexylamino)-N-(3,4-difluorophenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109112976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).