(5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone

C14H10BrNO2 — CID 43463185

IUPAC(5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone
SMILESCc1[nH]c2ccccc2c1C(=O)c1ccc(Br)o1
InChIInChI=1S/C14H10BrNO2/c1-8-13(9-4-2-3-5-10(9)16-8)14(17)11-6-7-12(15)18-11/h2-7,16H,1H3
InChIKeyLOFDWKGQDIMFFK-UHFFFAOYSA-N
MW304.14 g/mol
LogP4.06
Rot. Bonds2

About (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone

(5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone (PubChem CID 43463185) has the molecular formula C14H10BrNO2 and a molecular weight of 304.14 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone
PubChem CID43463185
Molecular FormulaC14H10BrNO2
Molecular Weight304.14 g/mol
Exact Mass302.99
IUPAC Name(5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone
SMILESCc1[nH]c2ccccc2c1C(=O)c1ccc(Br)o1
InChIInChI=1S/C14H10BrNO2/c1-8-13(9-4-2-3-5-10(9)16-8)14(17)11-6-7-12(15)18-11/h2-7,16H,1H3
InChIKeyLOFDWKGQDIMFFK-UHFFFAOYSA-N
XLogP4.06
TPSA46.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.14
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate
CID 2412811
5-bromo-N-[(2-methyl-1H-indol-3-yl)methyl]furan-2-carboxamide
CID 110794088
(2-methyl-1H-indol-3-yl)-(2-methylphenyl)methanone
CID 43339223
(5-bromothiophen-3-yl)-(2-methyl-1H-indol-3-yl)methanone
CID 114021021
(2,4-dibromophenyl)-(2-methyl-1H-indol-3-yl)methanone
CID 107949694
[(2R)-1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl] (E)-3-(5-bromofuran-2-yl)prop-2-enoate
CID 7868816
CID 170645728
CID 170645728
methyl 2-methyl-1H-indole-3-carboxylate
CID 594174
N,2-dimethyl-1H-indole-3-carboxamide
CID 20800690
1-(2-methyl-1H-indol-3-yl)-2-phenylethanone
CID 15577659
4-(2-methyl-1H-indole-3-carbonyl)benzonitrile
CID 10422724
(E)-4-(2-methyl-1H-indol-3-yl)pent-3-en-2-one
CID 66575320

Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone?
The IUPAC name of (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone (CID 43463185) is (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone.
What is the SMILES notation for (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone?
The canonical SMILES for (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone is Cc1[nH]c2ccccc2c1C(=O)c1ccc(Br)o1.
What is the InChIKey of (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone?
The InChIKey is LOFDWKGQDIMFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrNO2/c1-8-13(9-4-2-3-5-10(9)16-8)14(17)11-6-7-12(15)18-11/h2-7,16H,1H3.
What are the key properties of (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone?
(5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone has a molecular weight of 304.14 g/mol, XLogP of 4.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-2-yl)-(2-methyl-1H-indol-3-yl)methanone is sourced from PubChem (CID 43463185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).