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

C15H12F3N — CID 116530973

IUPACN-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
SMILESFc1ccc2c(c1)CCC2Nc1cccc(F)c1F
InChIInChI=1S/C15H12F3N/c16-10-5-6-11-9(8-10)4-7-13(11)19-14-3-1-2-12(17)15(14)18/h1-3,5-6,8,13,19H,4,7H2
InChIKeyGHOYJOLKOAMPEY-UHFFFAOYSA-N
MW263.26 g/mol
LogP4.20
Rot. Bonds2

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

N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine (PubChem CID 116530973) has the molecular formula C15H12F3N and a molecular weight of 263.26 g/mol. Its IUPAC name is N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
PubChem CID116530973
Molecular FormulaC15H12F3N
Molecular Weight263.26 g/mol
Exact Mass263.09
IUPAC NameN-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
SMILESFc1ccc2c(c1)CCC2Nc1cccc(F)c1F
InChIInChI=1S/C15H12F3N/c16-10-5-6-11-9(8-10)4-7-13(11)19-14-3-1-2-12(17)15(14)18/h1-3,5-6,8,13,19H,4,7H2
InChIKeyGHOYJOLKOAMPEY-UHFFFAOYSA-N
XLogP4.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-tert-butylphenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116530861
1-[2-[(5-fluoro-2,3-dihydro-1H-inden-1-yl)amino]phenyl]ethanol
CID 116530980
N-(2,6-dichlorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116531042
2,3,5,6-tetrafluoro-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)pyridin-4-amine
CID 133371682
4-fluoro-3-[(5-fluoro-2,3-dihydro-1H-inden-1-yl)amino]benzamide
CID 116530881
N-(5-fluoro-2-methylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 43195451
N-(2-bromo-4-fluorophenyl)-2,3-dihydro-1H-inden-1-amine
CID 43119403
N-(2,5-dichloro-4-methylphenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116531137
N-(5-bromo-2-chlorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 116531008
5-fluoro-N-(4-iodophenyl)-2,3-dihydro-1H-inden-1-amine
CID 116530824
5-fluoro-N-(3-methoxyphenyl)-2,3-dihydro-1H-inden-1-amine
CID 115916737
5-fluoro-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-inden-1-amine
CID 116530756

Frequently Asked Questions

What is the IUPAC name of N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine (CID 116530973) is N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine is Fc1ccc2c(c1)CCC2Nc1cccc(F)c1F.
What is the InChIKey of N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine?
The InChIKey is GHOYJOLKOAMPEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3N/c16-10-5-6-11-9(8-10)4-7-13(11)19-14-3-1-2-12(17)15(14)18/h1-3,5-6,8,13,19H,4,7H2.
What are the key properties of N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine?
N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine has a molecular weight of 263.26 g/mol, XLogP of 4.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-difluorophenyl)-5-fluoro-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 116530973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).