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

C15H13F2N — CID 83067325

IUPAC4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
SMILESFc1cccc(NC2CCc3c(F)cccc32)c1
InChIInChI=1S/C15H13F2N/c16-10-3-1-4-11(9-10)18-15-8-7-12-13(15)5-2-6-14(12)17/h1-6,9,15,18H,7-8H2
InChIKeyDDTDBKWWVQPGON-UHFFFAOYSA-N
MW245.27 g/mol
LogP4.06
Rot. Bonds2

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

4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 83067325) has the molecular formula C15H13F2N and a molecular weight of 245.27 g/mol. Its IUPAC name is 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID83067325
Molecular FormulaC15H13F2N
Molecular Weight245.27 g/mol
Exact Mass245.10
IUPAC Name4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
SMILESFc1cccc(NC2CCc3c(F)cccc32)c1
InChIInChI=1S/C15H13F2N/c16-10-3-1-4-11(9-10)18-15-8-7-12-13(15)5-2-6-14(12)17/h1-6,9,15,18H,7-8H2
InChIKeyDDTDBKWWVQPGON-UHFFFAOYSA-N
XLogP4.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.27
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine (CID 83067325) is 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine is Fc1cccc(NC2CCc3c(F)cccc32)c1.
What is the InChIKey of 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is DDTDBKWWVQPGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2N/c16-10-3-1-4-11(9-10)18-15-8-7-12-13(15)5-2-6-14(12)17/h1-6,9,15,18H,7-8H2.
What are the key properties of 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine?
4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 245.27 g/mol, XLogP of 4.06, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(3-fluorophenyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 83067325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).