N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide

C17H15BrN2O2 — CID 113209668

IUPACN-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
SMILESCOc1ccc2[nH]cc(CC(=O)Nc3ccc(Br)cc3)c2c1
InChIInChI=1S/C17H15BrN2O2/c1-22-14-6-7-16-15(9-14)11(10-19-16)8-17(21)20-13-4-2-12(18)3-5-13/h2-7,9-10,19H,8H2,1H3,(H,20,21)
InChIKeyBRYWLKIGIJKBNI-UHFFFAOYSA-N
MW359.22 g/mol
LogP4.12
Rot. Bonds4

About N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide

N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide (PubChem CID 113209668) has the molecular formula C17H15BrN2O2 and a molecular weight of 359.22 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
PubChem CID113209668
Molecular FormulaC17H15BrN2O2
Molecular Weight359.22 g/mol
Exact Mass358.03
IUPAC NameN-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
SMILESCOc1ccc2[nH]cc(CC(=O)Nc3ccc(Br)cc3)c2c1
InChIInChI=1S/C17H15BrN2O2/c1-22-14-6-7-16-15(9-14)11(10-19-16)8-17(21)20-13-4-2-12(18)3-5-13/h2-7,9-10,19H,8H2,1H3,(H,20,21)
InChIKeyBRYWLKIGIJKBNI-UHFFFAOYSA-N
XLogP4.12
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.22
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(hydroxymethyl)phenyl]-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 110910870
2-(5-methoxy-1H-indol-3-yl)-N-propan-2-ylacetamide
CID 110847876
N-(4-bromophenyl)-2-(1H-indol-3-yl)acetamide
CID 2093840
N-(2,6-dichlorophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 113209712
N-(4-bromophenyl)-6-methoxy-4-oxo-1H-quinoline-3-carboxamide
CID 43831869
N-[(2-fluorophenyl)methyl]-4-[[2-(5-methoxy-1H-indol-3-yl)acetyl]amino]benzamide
CID 78890740
methyl 2-[[2-(5-methoxy-1H-indol-3-yl)acetyl]amino]benzoate
CID 113209687
N-(2-hydroxypropyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 78872247
N-[(5-methoxy-1H-indol-3-yl)methyl]acetamide
CID 71554009
2-(5-methoxy-1H-indol-3-yl)-N-(2-methyl-1,3-thiazol-5-yl)acetamide
CID 154833363
4-methoxy-N-[(5-methoxy-1H-indol-3-yl)methyl]aniline
CID 20509727
N-(3-hydroxybutyl)-2-(5-methoxy-1H-indol-3-yl)acetamide
CID 111433362

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide?
The IUPAC name of N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide (CID 113209668) is N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide is COc1ccc2[nH]cc(CC(=O)Nc3ccc(Br)cc3)c2c1.
What is the InChIKey of N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide?
The InChIKey is BRYWLKIGIJKBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15BrN2O2/c1-22-14-6-7-16-15(9-14)11(10-19-16)8-17(21)20-13-4-2-12(18)3-5-13/h2-7,9-10,19H,8H2,1H3,(H,20,21).
What are the key properties of N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide?
N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide has a molecular weight of 359.22 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-(5-methoxy-1H-indol-3-yl)acetamide is sourced from PubChem (CID 113209668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).