2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole

C12H10BrNO — CID 65041798

IUPAC2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole
SMILESBrc1ccoc1C1Cc2ccccc2N1
InChIInChI=1S/C12H10BrNO/c13-9-5-6-15-12(9)11-7-8-3-1-2-4-10(8)14-11/h1-6,11,14H,7H2
InChIKeyKTKJVBKOZHBAEI-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.75
Rot. Bonds1

About 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole

2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole (PubChem CID 65041798) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole
PubChem CID65041798
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC Name2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole
SMILESBrc1ccoc1C1Cc2ccccc2N1
InChIInChI=1S/C12H10BrNO/c13-9-5-6-15-12(9)11-7-8-3-1-2-4-10(8)14-11/h1-6,11,14H,7H2
InChIKeyKTKJVBKOZHBAEI-UHFFFAOYSA-N
XLogP3.75
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.12
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(4-bromophenyl)-2,3-dihydro-1H-indole
CID 7144522
(2R)-2-phenyl-2,3-dihydro-1H-indole
CID 7004228
2-(4-ethylphenyl)-2,3-dihydro-1H-indole
CID 3934310
(2S)-2-[(2S)-2,3-dihydro-1H-indol-2-yl]-2,3-dihydro-1H-indole
CID 139181598
(2S)-2-(furan-2-yl)-1,2,3,4-tetrahydroquinoline
CID 134957787
2-(4-methylsulfanylphenyl)-2,3-dihydro-1H-indole
CID 4553676
2-(2-chloro-5-fluorophenyl)-2,3-dihydro-1H-indole
CID 105395861
5-(2,3-dihydro-1H-indol-2-yl)-3-methyl-1,2,4-oxadiazole
CID 43111055
2-(5-chlorothiophen-2-yl)-2,3-dihydro-1H-indole
CID 4018143
(2S)-2-(4-propan-2-ylphenyl)-2,3-dihydro-1H-indole
CID 7047714
(2R)-2-(4-propan-2-ylphenyl)-2,3-dihydro-1H-indole
CID 7047713
[(2S)-2,3-dihydro-1H-indol-2-yl]methanamine
CID 82667971

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole?
The IUPAC name of 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole (CID 65041798) is 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole?
The canonical SMILES for 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole is Brc1ccoc1C1Cc2ccccc2N1.
What is the InChIKey of 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole?
The InChIKey is KTKJVBKOZHBAEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c13-9-5-6-15-12(9)11-7-8-3-1-2-4-10(8)14-11/h1-6,11,14H,7H2.
What are the key properties of 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole?
2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole has a molecular weight of 264.12 g/mol, XLogP of 3.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromofuran-2-yl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 65041798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).