1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine

C15H14Cl2N2 — CID 29080631

IUPAC1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine
SMILESNc1ccc2c(c1)N(Cc1c(Cl)cccc1Cl)CC2
InChIInChI=1S/C15H14Cl2N2/c16-13-2-1-3-14(17)12(13)9-19-7-6-10-4-5-11(18)8-15(10)19/h1-5,8H,6-7,9,18H2
InChIKeyYXOORHUKMSGGOA-UHFFFAOYSA-N
MW293.20 g/mol
LogP4.14
Rot. Bonds2

About 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine

1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine (PubChem CID 29080631) has the molecular formula C15H14Cl2N2 and a molecular weight of 293.20 g/mol. Its IUPAC name is 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine.

Molecular Properties

Compound Name1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine
PubChem CID29080631
Molecular FormulaC15H14Cl2N2
Molecular Weight293.20 g/mol
Exact Mass292.05
IUPAC Name1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine
SMILESNc1ccc2c(c1)N(Cc1c(Cl)cccc1Cl)CC2
InChIInChI=1S/C15H14Cl2N2/c16-13-2-1-3-14(17)12(13)9-19-7-6-10-4-5-11(18)8-15(10)19/h1-5,8H,6-7,9,18H2
InChIKeyYXOORHUKMSGGOA-UHFFFAOYSA-N
XLogP4.14
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.20
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Indolin-6-ylamine hydrochloride
CID 34184
(2,6-Dichlorobenzyl)[4-(1-pyrrolidinyl)phenyl]amine
CID 893102
4-Chloroindoline
CID 3016306
6-Aminoindoline dihydrochloride
CID 24801896
1-methyl-2,3-dihydro-1H-indol-6-amine dihydrochloride
CID 86767571
4,4'-Methylenebis(5-chloro-N~1~,N~1~-dimethylbenzene-1,3-diamine)
CID 407095
3-Chloro-4-[[5-(trifluoromethyl)-2,3-dihydroindol-1-yl]methyl]aniline
CID 137531682
1-[2-Chloro-4-(trifluoromethyl)phenyl]-2,3-dihydroindol-4-amine
CID 176884690
DI[2-Amino-4-(dimethylamino)-5-chloro]methane, dihydrocloride
CID 24180830
4-[[2-amino-6-chloro-4-(diethylamino)phenyl]methyl]-5-chloro-1-N,1-N-diethylbenzene-1,3-diamine;hydrochloride
CID 24184181
1-[(3-Chlorophenyl)methyl]-2,3-dihydroindole
CID 15379874
1-(4-Chlorobenzyl) indolin-5-amine
CID 28418888

Frequently Asked Questions

What is the IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine?
The IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine (CID 29080631) is 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine.
What is the SMILES notation for 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine?
The canonical SMILES for 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine is Nc1ccc2c(c1)N(Cc1c(Cl)cccc1Cl)CC2.
What is the InChIKey of 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine?
The InChIKey is YXOORHUKMSGGOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2/c16-13-2-1-3-14(17)12(13)9-19-7-6-10-4-5-11(18)8-15(10)19/h1-5,8H,6-7,9,18H2.
What are the key properties of 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine?
1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine has a molecular weight of 293.20 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine is sourced from PubChem (CID 29080631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).