7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine

C10H13BrN2 — CID 83758541

IUPAC7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine
SMILESCNC1CN(C)c2c(Br)cccc21
InChIInChI=1S/C10H13BrN2/c1-12-9-6-13(2)10-7(9)4-3-5-8(10)11/h3-5,9,12H,6H2,1-2H3
InChIKeyXCOLXLYWKSFIKA-UHFFFAOYSA-N
MW241.13 g/mol
LogP2.16
Rot. Bonds1

About 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine

7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine (PubChem CID 83758541) has the molecular formula C10H13BrN2 and a molecular weight of 241.13 g/mol. Its IUPAC name is 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine.

Molecular Properties

Compound Name7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine
PubChem CID83758541
Molecular FormulaC10H13BrN2
Molecular Weight241.13 g/mol
Exact Mass240.03
IUPAC Name7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine
SMILESCNC1CN(C)c2c(Br)cccc21
InChIInChI=1S/C10H13BrN2/c1-12-9-6-13(2)10-7(9)4-3-5-8(10)11/h3-5,9,12H,6H2,1-2H3
InChIKeyXCOLXLYWKSFIKA-UHFFFAOYSA-N
XLogP2.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.13
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-bromo-N-methyl-3,4-dihydro-2H-thiochromen-4-amine
CID 43539404
8-bromo-1-methyl-3,4-dihydro-2H-quinoline-4-carbonitrile
CID 83760267
8-bromo-4-isocyanato-1-methyl-3,4-dihydro-2H-quinoline
CID 83844594
8-bromo-4-(methylamino)-3,4-dihydro-1H-quinolin-2-one
CID 84635515
9-bromo-N-methyl-1,1-dioxo-2,3,4,5-tetrahydro-1λ6-benzothiepin-5-amine
CID 43539606
7-bromo-N-ethyl-2,3-dihydro-1-benzothiophen-3-amine
CID 43539433
1-(1,3-dimethyl-2,3-dihydroindol-7-yl)-N-methylmethanamine
CID 117204112
1-(4-bromo-1-methyl-2,3-dihydroindol-3-yl)-N-methylmethanamine
CID 117199958
8-bromo-N-ethyl-3,4-dihydro-2H-thiochromen-4-amine
CID 43539442
7-bromo-N-cyclopropyl-2,3-dihydro-1-benzothiophen-3-amine
CID 43539443
9-(2-bromo-6-fluorophenyl)-N-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 107603600
3-(methylamino)-2,3-dihydro-1-benzofuran-7-ol
CID 112546911

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine?
The IUPAC name of 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine (CID 83758541) is 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine.
What is the SMILES notation for 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine?
The canonical SMILES for 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine is CNC1CN(C)c2c(Br)cccc21.
What is the InChIKey of 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine?
The InChIKey is XCOLXLYWKSFIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2/c1-12-9-6-13(2)10-7(9)4-3-5-8(10)11/h3-5,9,12H,6H2,1-2H3.
What are the key properties of 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine?
7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine has a molecular weight of 241.13 g/mol, XLogP of 2.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N,1-dimethyl-2,3-dihydroindol-3-amine is sourced from PubChem (CID 83758541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).