5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine

C15H12Cl3N — CID 115349088

IUPAC5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine
SMILESClc1ccc2c(c1)CC(Nc1c(Cl)cccc1Cl)C2
InChIInChI=1S/C15H12Cl3N/c16-11-5-4-9-7-12(8-10(9)6-11)19-15-13(17)2-1-3-14(15)18/h1-6,12,19H,7-8H2
InChIKeyBUTQEDIESCJFEN-UHFFFAOYSA-N
MW312.63 g/mol
LogP5.23
Rot. Bonds2

About 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine

5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine (PubChem CID 115349088) has the molecular formula C15H12Cl3N and a molecular weight of 312.63 g/mol. Its IUPAC name is 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound Name5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine
PubChem CID115349088
Molecular FormulaC15H12Cl3N
Molecular Weight312.63 g/mol
Exact Mass311.00
IUPAC Name5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine
SMILESClc1ccc2c(c1)CC(Nc1c(Cl)cccc1Cl)C2
InChIInChI=1S/C15H12Cl3N/c16-11-5-4-9-7-12(8-10(9)6-11)19-15-13(17)2-1-3-14(15)18/h1-6,12,19H,7-8H2
InChIKeyBUTQEDIESCJFEN-UHFFFAOYSA-N
XLogP5.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.63
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-chloro-N-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-inden-2-amine
CID 115349107
N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine
CID 65467595
5-chloro-N-(3-chloro-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine
CID 115348720
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)naphthalen-1-amine
CID 115348592
2-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]-3-methoxybenzonitrile
CID 107466723
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-6-fluoropyridin-2-amine
CID 116812769
5-chloro-N-(5-chloro-2-methylphenyl)-2,3-dihydro-1H-inden-2-amine
CID 115348580
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)naphthalen-2-amine
CID 115348786
6-bromo-N-(2,6-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 65469337
5-chloro-N-prop-2-ynyl-2,3-dihydro-1H-inden-2-amine
CID 81300469
N-(4-bromo-3-fluorophenyl)-5-chloro-2,3-dihydro-1H-inden-2-amine
CID 115349085
5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
CID 115348779

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine (CID 115349088) is 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine is Clc1ccc2c(c1)CC(Nc1c(Cl)cccc1Cl)C2.
What is the InChIKey of 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine?
The InChIKey is BUTQEDIESCJFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl3N/c16-11-5-4-9-7-12(8-10(9)6-11)19-15-13(17)2-1-3-14(15)18/h1-6,12,19H,7-8H2.
What are the key properties of 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine?
5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine has a molecular weight of 312.63 g/mol, XLogP of 5.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 115349088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).