(5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone

C14H10BrNO2 — CID 43463712

IUPAC(5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone
SMILESCc1ccc2c(C(=O)c3ccc(Br)o3)c[nH]c2c1
InChIInChI=1S/C14H10BrNO2/c1-8-2-3-9-10(7-16-11(9)6-8)14(17)12-4-5-13(15)18-12/h2-7,16H,1H3
InChIKeyXXPZYMQGLRBQSZ-UHFFFAOYSA-N
MW304.14 g/mol
LogP4.06
Rot. Bonds2

About (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone

(5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone (PubChem CID 43463712) has the molecular formula C14H10BrNO2 and a molecular weight of 304.14 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone
PubChem CID43463712
Molecular FormulaC14H10BrNO2
Molecular Weight304.14 g/mol
Exact Mass302.99
IUPAC Name(5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone
SMILESCc1ccc2c(C(=O)c3ccc(Br)o3)c[nH]c2c1
InChIInChI=1S/C14H10BrNO2/c1-8-2-3-9-10(7-16-11(9)6-8)14(17)12-4-5-13(15)18-12/h2-7,16H,1H3
InChIKeyXXPZYMQGLRBQSZ-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

(5-bromofuran-2-yl)-(2,5-dimethylphenyl)methanone
CID 43462525
(2-amino-5-methylphenyl)-(6-methyl-1H-indol-3-yl)methanone
CID 65453793
(5-bromofuran-2-yl)-(5-propan-2-yloxy-1H-indol-3-yl)methanone
CID 80649231
(2-bromo-3-methylphenyl)-(6-methyl-1H-indol-3-yl)methanone
CID 107981662
(3-bromo-4-methylphenyl)-(6-methyl-1H-indol-3-yl)methanone
CID 81472433
(5-bromofuran-2-yl)-(2-chloro-4-methylphenyl)methanone
CID 106860843
(2-amino-5-methylphenyl)-(6-bromo-1H-indol-3-yl)methanone
CID 65455500
(6-methyl-1H-indol-3-yl)-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 24823778
2-chloro-1-(6-methyl-1H-indol-3-yl)propan-1-one
CID 43163342
(6-methyl-1H-indol-3-yl)-pyridin-3-ylmethanone
CID 43341972
ethyl 2-(6-methyl-1H-indol-3-yl)-2-oxoacetate
CID 55017679
(4-amino-3-chlorophenyl)-(6-methyl-1H-indol-3-yl)methanone
CID 82787189

Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone?
The IUPAC name of (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone (CID 43463712) is (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone.
What is the SMILES notation for (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone?
The canonical SMILES for (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone is Cc1ccc2c(C(=O)c3ccc(Br)o3)c[nH]c2c1.
What is the InChIKey of (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone?
The InChIKey is XXPZYMQGLRBQSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrNO2/c1-8-2-3-9-10(7-16-11(9)6-8)14(17)12-4-5-13(15)18-12/h2-7,16H,1H3.
What are the key properties of (5-bromofuran-2-yl)-(6-methyl-1H-indol-3-yl)methanone?
(5-bromofuran-2-yl)-(6-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)-(6-methyl-1H-indol-3-yl)methanone is sourced from PubChem (CID 43463712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).