N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide

C17H19FN4O — CID 113038874

IUPACN-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1ccc(NC2CCCC2)nn1
InChIInChI=1S/C17H19FN4O/c18-13-5-3-4-12(10-13)11-17(23)20-16-9-8-15(21-22-16)19-14-6-1-2-7-14/h3-5,8-10,14H,1-2,6-7,11H2,(H,19,21)(H,20,22,23)
InChIKeySFEHHYVLWOSSIY-UHFFFAOYSA-N
MW314.36 g/mol
LogP3.15
Rot. Bonds5

About N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide

N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide (PubChem CID 113038874) has the molecular formula C17H19FN4O and a molecular weight of 314.36 g/mol. Its IUPAC name is N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide
PubChem CID113038874
Molecular FormulaC17H19FN4O
Molecular Weight314.36 g/mol
Exact Mass314.15
IUPAC NameN-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1ccc(NC2CCCC2)nn1
InChIInChI=1S/C17H19FN4O/c18-13-5-3-4-12(10-13)11-17(23)20-16-9-8-15(21-22-16)19-14-6-1-2-7-14/h3-5,8-10,14H,1-2,6-7,11H2,(H,19,21)(H,20,22,23)
InChIKeySFEHHYVLWOSSIY-UHFFFAOYSA-N
XLogP3.15
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(cyclohexylamino)-3-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113010094
2-(3-fluorophenyl)-N-(6-piperidin-1-ylpyridazin-3-yl)acetamide
CID 113038996
2-(3-fluorophenyl)-N-[6-[(4-fluorophenyl)methylamino]pyridazin-3-yl]acetamide
CID 113041483
N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113038853
2-(3-fluorophenyl)-N-[6-(4-pyrrolidin-1-ylanilino)pyridazin-3-yl]acetamide
CID 113049731
N-[6-[2-(dimethylamino)ethylamino]pyridazin-3-yl]-2-(3-fluorophenyl)acetamide
CID 113039942
2-(3-fluorophenyl)-N-[6-(2-methoxyethylamino)pyridazin-3-yl]acetamide
CID 113039451
N-[4-(cyclopentylamino)-2-oxochromen-3-yl]-2-(3-fluorophenyl)acetamide
CID 50744190
N-[2-(cycloheptylamino)ethyl]-2-(3-fluorophenyl)acetamide;hydrochloride
CID 119261120
N-[6-(cyclohexylamino)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113010072
2-(4-chlorophenyl)-N-[6-(cyclopropylamino)pyridazin-3-yl]acetamide
CID 113038076
N-[6-(cyclopentylamino)pyridazin-3-yl]-3-methylbutanamide
CID 113038820

Frequently Asked Questions

What is the IUPAC name of N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide?
The IUPAC name of N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide (CID 113038874) is N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide.
What is the SMILES notation for N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide?
The canonical SMILES for N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide is O=C(Cc1cccc(F)c1)Nc1ccc(NC2CCCC2)nn1.
What is the InChIKey of N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide?
The InChIKey is SFEHHYVLWOSSIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN4O/c18-13-5-3-4-12(10-13)11-17(23)20-16-9-8-15(21-22-16)19-14-6-1-2-7-14/h3-5,8-10,14H,1-2,6-7,11H2,(H,19,21)(H,20,22,23).
What are the key properties of N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide?
N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide has a molecular weight of 314.36 g/mol, XLogP of 3.15, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide is sourced from PubChem (CID 113038874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).