N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide

C16H14BrN3O2 — CID 29139061

IUPACN-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide
SMILESCOc1ccc2c(ccn2CC(=O)Nc2ccc(Br)cn2)c1
InChIInChI=1S/C16H14BrN3O2/c1-22-13-3-4-14-11(8-13)6-7-20(14)10-16(21)19-15-5-2-12(17)9-18-15/h2-9H,10H2,1H3,(H,18,19,21)
InChIKeyABHZBVGCPOCLON-UHFFFAOYSA-N
MW360.21 g/mol
LogP3.45
Rot. Bonds4

About N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide

N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide (PubChem CID 29139061) has the molecular formula C16H14BrN3O2 and a molecular weight of 360.21 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide
PubChem CID29139061
Molecular FormulaC16H14BrN3O2
Molecular Weight360.21 g/mol
Exact Mass359.03
IUPAC NameN-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide
SMILESCOc1ccc2c(ccn2CC(=O)Nc2ccc(Br)cn2)c1
InChIInChI=1S/C16H14BrN3O2/c1-22-13-3-4-14-11(8-13)6-7-20(14)10-16(21)19-15-5-2-12(17)9-18-15/h2-9H,10H2,1H3,(H,18,19,21)
InChIKeyABHZBVGCPOCLON-UHFFFAOYSA-N
XLogP3.45
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.21
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide
CID 29131192
2-(5-methoxyindol-1-yl)-N-pyridin-2-ylacetamide
CID 29137208
2-(5-methoxyindol-1-yl)-N-(5-piperidin-1-yl-2-pyridinyl)acetamide
CID 78878201
N-(5-bromo-2-pyridinyl)-2-(2-methoxy-9-oxoacridin-10-yl)acetamide
CID 15997885
N-tert-butyl-2-(5-methoxyindol-1-yl)acetamide
CID 115582184
N-[(3-bromophenyl)methyl]-2-(5-methoxyindol-1-yl)acetamide
CID 55718467
2-(5-methoxyindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 29133435
methyl 4-[[2-(5-methoxyindol-1-yl)acetyl]amino]benzoate
CID 29135985
N-(5-bromo-2-pyridinyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]acetamide
CID 6467505
2-(5-methoxyindol-1-yl)-N-prop-2-ynylacetamide
CID 115582181
(2S)-2-[[2-(5-methoxyindol-1-yl)acetyl]amino]propanoic acid
CID 39377928
2-(5-bromoindol-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
CID 42537123

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide (CID 29139061) is N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide is COc1ccc2c(ccn2CC(=O)Nc2ccc(Br)cn2)c1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide?
The InChIKey is ABHZBVGCPOCLON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrN3O2/c1-22-13-3-4-14-11(8-13)6-7-20(14)10-16(21)19-15-5-2-12(17)9-18-15/h2-9H,10H2,1H3,(H,18,19,21).
What are the key properties of N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide?
N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide has a molecular weight of 360.21 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-2-(5-methoxyindol-1-yl)acetamide is sourced from PubChem (CID 29139061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).