5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine

C15H13FIN — CID 116530824

IUPAC5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine
SMILESFc1ccc2c(c1)CCC2Nc1ccc(I)cc1
InChIInChI=1S/C15H13FIN/c16-11-2-7-14-10(9-11)1-8-15(14)18-13-5-3-12(17)4-6-13/h2-7,9,15,18H,1,8H2
InChIKeyVCEILRIMFXRUCS-UHFFFAOYSA-N
MW353.18 g/mol
LogP4.53
Rot. Bonds2

About 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine

5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 116530824) has the molecular formula C15H13FIN and a molecular weight of 353.18 g/mol. Its IUPAC name is 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID116530824
Molecular FormulaC15H13FIN
Molecular Weight353.18 g/mol
Exact Mass353.01
IUPAC Name5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine
SMILESFc1ccc2c(c1)CCC2Nc1ccc(I)cc1
InChIInChI=1S/C15H13FIN/c16-11-2-7-14-10(9-11)1-8-15(14)18-13-5-3-12(17)4-6-13/h2-7,9,15,18H,1,8H2
InChIKeyVCEILRIMFXRUCS-UHFFFAOYSA-N
XLogP4.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.18
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine 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-[4-(difluoromethoxy)phenyl]-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 115917148
N-(4-ethoxyphenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 115915933
N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-2,3-dihydro-1,4-benzodioxin-6-amine
CID 115929026
5-fluoro-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-inden-1-amine
CID 116530756
5-fluoro-N-(3-methoxyphenyl)-2,3-dihydro-1H-inden-1-amine
CID 115916737
N-(2,6-dichlorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116531042
3-[(5-fluoro-2,3-dihydro-1H-inden-1-yl)amino]benzoic acid
CID 116530834
N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116530973
2,3,5,6-tetrafluoro-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)pyridin-4-amine
CID 133371682
5-fluoro-N-[3-(methoxymethyl)phenyl]-2,3-dihydro-1H-inden-1-amine
CID 115918170
N-cyclooctyl-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116530769
1-(4-iodoanilino)-2,3-dihydro-1H-inden-4-ol
CID 43637127

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine (CID 116530824) is 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine is Fc1ccc2c(c1)CCC2Nc1ccc(I)cc1.
What is the InChIKey of 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is VCEILRIMFXRUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FIN/c16-11-2-7-14-10(9-11)1-8-15(14)18-13-5-3-12(17)4-6-13/h2-7,9,15,18H,1,8H2.
What are the key properties of 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine?
5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 353.18 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 116530824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).