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

C15H12Cl2FN — CID 115348720

IUPAC5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine
SMILESFc1ccc(NC2Cc3ccc(Cl)cc3C2)cc1Cl
InChIInChI=1S/C15H12Cl2FN/c16-11-2-1-9-6-13(7-10(9)5-11)19-12-3-4-15(18)14(17)8-12/h1-5,8,13,19H,6-7H2
InChIKeyWPPXPZKYSZSCCS-UHFFFAOYSA-N
MW296.17 g/mol
LogP4.71
Rot. Bonds2

About 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine

5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine (PubChem CID 115348720) has the molecular formula C15H12Cl2FN and a molecular weight of 296.17 g/mol. Its IUPAC name is 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound Name5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine
PubChem CID115348720
Molecular FormulaC15H12Cl2FN
Molecular Weight296.17 g/mol
Exact Mass295.03
IUPAC Name5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine
SMILESFc1ccc(NC2Cc3ccc(Cl)cc3C2)cc1Cl
InChIInChI=1S/C15H12Cl2FN/c16-11-2-1-9-6-13(7-10(9)5-11)19-12-3-4-15(18)14(17)8-12/h1-5,8,13,19H,6-7H2
InChIKeyWPPXPZKYSZSCCS-UHFFFAOYSA-N
XLogP4.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.17
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-bromo-3-fluorophenyl)-5-chloro-2,3-dihydro-1H-inden-2-amine
CID 115349085
2-chloro-4-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]benzamide
CID 115348892
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)naphthalen-2-amine
CID 115348786
6-bromo-N-(3-chloro-4-fluorophenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63625335
5-chloro-N-(3-chloro-4-ethoxyphenyl)-2,3-dihydro-1H-inden-2-amine
CID 115348945
3-chloro-N-cyclopentyl-4-fluoroaniline
CID 28938400
5-chloro-N-[4-(difluoromethylsulfanyl)phenyl]-2,3-dihydro-1H-inden-2-amine
CID 115348768
5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine
CID 115349088
N-(3,4-difluorophenyl)-2,3-dihydro-1H-inden-2-amine
CID 43512824
5-chloro-N-(4-nitrophenyl)-2,3-dihydro-1H-inden-2-amine
CID 115348856
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1H-indazol-5-amine
CID 115348820
N-(3-chloro-4-fluorophenyl)-1,1-dioxothian-4-amine
CID 43511704

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine (CID 115348720) is 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine is Fc1ccc(NC2Cc3ccc(Cl)cc3C2)cc1Cl.
What is the InChIKey of 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine?
The InChIKey is WPPXPZKYSZSCCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2FN/c16-11-2-1-9-6-13(7-10(9)5-11)19-12-3-4-15(18)14(17)8-12/h1-5,8,13,19H,6-7H2.
What are the key properties of 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine?
5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine has a molecular weight of 296.17 g/mol, XLogP of 4.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 115348720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).