N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide

C17H17FN4O2 — CID 118600317

IUPACN-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide
SMILESCCN1C(=O)C(C)(C)c2cc(F)c(NC(=O)c3ccnnc3)cc21
InChIInChI=1S/C17H17FN4O2/c1-4-22-14-8-13(21-15(23)10-5-6-19-20-9-10)12(18)7-11(14)17(2,3)16(22)24/h5-9H,4H2,1-3H3,(H,21,23)
InChIKeyVLWIGJDBRZQWQB-UHFFFAOYSA-N
MW328.35 g/mol
LogP2.51
Rot. Bonds3

About N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide

N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide (PubChem CID 118600317) has the molecular formula C17H17FN4O2 and a molecular weight of 328.35 g/mol. Its IUPAC name is N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide.

Molecular Properties

Compound NameN-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide
PubChem CID118600317
Molecular FormulaC17H17FN4O2
Molecular Weight328.35 g/mol
Exact Mass328.13
IUPAC NameN-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide
SMILESCCN1C(=O)C(C)(C)c2cc(F)c(NC(=O)c3ccnnc3)cc21
InChIInChI=1S/C17H17FN4O2/c1-4-22-14-8-13(21-15(23)10-5-6-19-20-9-10)12(18)7-11(14)17(2,3)16(22)24/h5-9H,4H2,1-3H3,(H,21,23)
InChIKeyVLWIGJDBRZQWQB-UHFFFAOYSA-N
XLogP2.51
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-fluoro-1,3,3-trimethyl-2-oxoindol-6-yl)pyridine-4-carboxamide
CID 73425720
3-fluoro-4-(pyridazine-4-carbonylamino)benzoic acid
CID 112555172
N-(4-bromo-2-fluorophenyl)pyridazine-4-carboxamide
CID 112702158
4-[[2-[(1-ethyl-3,3-dimethyl-2-oxoindol-5-yl)amino]-5-fluoropyrimidin-4-yl]amino]-N-pyridin-2-ylbenzamide
CID 59868880
N-(5-amino-2-methylphenyl)pyridazine-4-carboxamide
CID 104669036
(1-ethyl-3,3-dimethyl-2-oxoindol-5-yl)thiourea
CID 169359553
N-[5-(5-ethyl-7,7-dimethyl-6-oxo-1H-pyrrolo[2,3-f]benzimidazol-2-yl)-1H-pyrazol-4-yl]-5-methylthiophene-2-carboxamide
CID 135501849
3,3-dimethyl-2-oxo-N-phenyl-1-propylindole-6-carboxamide
CID 19832370
1-ethyl-5-(1-hydroxyethyl)-3,3-dimethylindol-2-one
CID 82172383
5,6-diamino-1-ethyl-3,3-dimethylindol-2-one;dihydrochloride
CID 70421420
methyl 2-[5-[(4-fluorobenzoyl)amino]-3,3-dimethyl-2-oxoindol-1-yl]acetate
CID 75538510
N-[5-(5-ethyl-7,7-dimethyl-6-oxo-1H-pyrrolo[2,3-f]benzimidazol-2-yl)-1H-pyrazol-4-yl]-1-benzofuran-2-carboxamide
CID 135501852

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide?
The IUPAC name of N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide (CID 118600317) is N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide.
What is the SMILES notation for N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide?
The canonical SMILES for N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide is CCN1C(=O)C(C)(C)c2cc(F)c(NC(=O)c3ccnnc3)cc21.
What is the InChIKey of N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide?
The InChIKey is VLWIGJDBRZQWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN4O2/c1-4-22-14-8-13(21-15(23)10-5-6-19-20-9-10)12(18)7-11(14)17(2,3)16(22)24/h5-9H,4H2,1-3H3,(H,21,23).
What are the key properties of N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide?
N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide has a molecular weight of 328.35 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-5-fluoro-3,3-dimethyl-2-oxoindol-6-yl)pyridazine-4-carboxamide is sourced from PubChem (CID 118600317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).