3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide

C16H13FIN3O2 — CID 25012018

IUPAC3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide
SMILESCN(C)C(=O)c1oc2ccncc2c1Nc1ccc(I)cc1F
InChIInChI=1S/C16H13FIN3O2/c1-21(2)16(22)15-14(10-8-19-6-5-13(10)23-15)20-12-4-3-9(18)7-11(12)17/h3-8,20H,1-2H3
InChIKeyKZJDJTXUOLYJTB-UHFFFAOYSA-N
MW425.20 g/mol
LogP4.02
Rot. Bonds3

About 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide

3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide (PubChem CID 25012018) has the molecular formula C16H13FIN3O2 and a molecular weight of 425.20 g/mol. Its IUPAC name is 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide
PubChem CID25012018
Molecular FormulaC16H13FIN3O2
Molecular Weight425.20 g/mol
Exact Mass425.00
IUPAC Name3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide
SMILESCN(C)C(=O)c1oc2ccncc2c1Nc1ccc(I)cc1F
InChIInChI=1S/C16H13FIN3O2/c1-21(2)16(22)15-14(10-8-19-6-5-13(10)23-15)20-12-4-3-9(18)7-11(12)17/h3-8,20H,1-2H3
InChIKeyKZJDJTXUOLYJTB-UHFFFAOYSA-N
XLogP4.02
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.20
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-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

G-573
CID 46926364
N-{[(2r)-2,3-Dihydroxypropyl]oxy}-3-[(2-Fluoro-4-Iodophenyl)amino]furo[3,2-C]pyridine-2-Carboxamide
CID 24743899
3-((2-Fluoro-4-iodophenyl)amino)-N-(2-hydroxyethoxy)furo[3,2-c]pyridine-2-carboxamide
CID 25013308
9-dimethylamino-3-(4''-methyl-1''-cyclohexyl)-3H-1,3,6-triazafluoren-4-one
CID 11493585
Benzofuran-2-yl(4-fluoro-4-(((5-methylpyridin-2-yl)methylamino)methyl)piperidin-1-yl)methanone
CID 42606572
2-Ethyl-7-methoxyfuro[2,3-c]pyridine-4-carboxylic acid (2,6-difluorophenyl)amide
CID 44365329
5-[[3-(1-Benzofuran-2-carbonylamino)phenyl]methoxy]pyridine-3-carboxamide
CID 124156875
N-(6-methoxypyridin-3-yl)-1-benzofuran-2-carboxamide
CID 1503572
3-methyl-N-pyridin-4-yl-1-benzofuran-2-carboxamide
CID 648777
4-methyl-N-(pyridin-2-ylmethyl)furo[3,2-c]quinoline-2-carboxamide
CID 3237079
3-[[(1E)-1-hydroxyimino-2,3-dihydroinden-5-yl]amino]-N,N-dimethylfuro[2,3-c]pyridine-2-carboxamide
CID 53316581
N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide
CID 4825824

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide?
The IUPAC name of 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide (CID 25012018) is 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide.
What is the SMILES notation for 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide?
The canonical SMILES for 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide is CN(C)C(=O)c1oc2ccncc2c1Nc1ccc(I)cc1F.
What is the InChIKey of 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide?
The InChIKey is KZJDJTXUOLYJTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FIN3O2/c1-21(2)16(22)15-14(10-8-19-6-5-13(10)23-15)20-12-4-3-9(18)7-11(12)17/h3-8,20H,1-2H3.
What are the key properties of 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide?
3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide has a molecular weight of 425.20 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-4-iodoanilino)-N,N-dimethylfuro[3,2-c]pyridine-2-carboxamide is sourced from PubChem (CID 25012018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).