6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide

C12H8FN5O — CID 62155166

IUPAC6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide
SMILESN#Cc1c(F)cccc1NC(=O)c1ccc(N)nn1
InChIInChI=1S/C12H8FN5O/c13-8-2-1-3-9(7(8)6-14)16-12(19)10-4-5-11(15)18-17-10/h1-5H,(H2,15,18)(H,16,19)
InChIKeyGHHMEMFSYJRDHZ-UHFFFAOYSA-N
MW257.23 g/mol
LogP1.32
Rot. Bonds2

About 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide

6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide (PubChem CID 62155166) has the molecular formula C12H8FN5O and a molecular weight of 257.23 g/mol. Its IUPAC name is 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide
PubChem CID62155166
Molecular FormulaC12H8FN5O
Molecular Weight257.23 g/mol
Exact Mass257.07
IUPAC Name6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide
SMILESN#Cc1c(F)cccc1NC(=O)c1ccc(N)nn1
InChIInChI=1S/C12H8FN5O/c13-8-2-1-3-9(7(8)6-14)16-12(19)10-4-5-11(15)18-17-10/h1-5H,(H2,15,18)(H,16,19)
InChIKeyGHHMEMFSYJRDHZ-UHFFFAOYSA-N
XLogP1.32
TPSA104.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.23
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-cyano-3-fluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62235962
6-amino-N-(2,3-difluorophenyl)pyridazine-3-carboxamide
CID 55041797
6-chloro-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 62232716
N-(2-cyano-3-fluorophenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62169600
6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide
CID 55043296
5-cyano-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 63724379
6-[(2-cyano-3-fluorophenyl)carbamoyl]pyridine-3-carboxylic acid
CID 43580818
N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62240838
4-chloro-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 43580727
2-chloro-N-(2-cyano-3-fluorophenyl)-3-fluorobenzamide
CID 79035734
N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide
CID 95763379
3-amino-N-(2-cyano-3-fluorophenyl)propanamide
CID 43580751

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide (CID 62155166) is 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide is N#Cc1c(F)cccc1NC(=O)c1ccc(N)nn1.
What is the InChIKey of 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide?
The InChIKey is GHHMEMFSYJRDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN5O/c13-8-2-1-3-9(7(8)6-14)16-12(19)10-4-5-11(15)18-17-10/h1-5H,(H2,15,18)(H,16,19).
What are the key properties of 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide?
6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide has a molecular weight of 257.23 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 62155166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).