1-(2-phenyl-1H-indol-5-yl)ethanone

C16H13NO — CID 44542857

IUPAC1-(2-phenyl-1H-indol-5-yl)ethanone
SMILESCC(=O)c1ccc2[nH]c(-c3ccccc3)cc2c1
InChIInChI=1S/C16H13NO/c1-11(18)13-7-8-15-14(9-13)10-16(17-15)12-5-3-2-4-6-12/h2-10,17H,1H3
InChIKeyNPSOXGMUSDOEEQ-UHFFFAOYSA-N
MW235.29 g/mol
LogP4.04
Rot. Bonds2

About 1-(2-phenyl-1H-indol-5-yl)ethanone

1-(2-phenyl-1H-indol-5-yl)ethanone (PubChem CID 44542857) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 1-(2-phenyl-1H-indol-5-yl)ethanone.

Molecular Properties

Compound Name1-(2-phenyl-1H-indol-5-yl)ethanone
PubChem CID44542857
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name1-(2-phenyl-1H-indol-5-yl)ethanone
SMILESCC(=O)c1ccc2[nH]c(-c3ccccc3)cc2c1
InChIInChI=1S/C16H13NO/c1-11(18)13-7-8-15-14(9-13)10-16(17-15)12-5-3-2-4-6-12/h2-10,17H,1H3
InChIKeyNPSOXGMUSDOEEQ-UHFFFAOYSA-N
XLogP4.04
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenyl-1H-indole-6-carboxamide
CID 69443786
tert-butyl N-(2-phenyl-1H-indol-5-yl)carbamate
CID 86048174
2-[4-[(4-methoxybenzoyl)amino]phenyl]-N-phenyl-1H-indole-5-carboxamide
CID 10389580
(2-phenyl-1H-indol-5-yl)methanol
CID 44577788
2-(2-hydroxyphenyl)-1H-indole-5-carboxylic acid
CID 54131699
methyl 2-(4-aminophenyl)-1H-indole-5-carboxylate
CID 69224754
3-chloro-4-[(2-phenyl-1H-indol-5-yl)oxy]benzoic acid
CID 11793101
2-[4-(4-ethanimidoylphenyl)phenyl]-1H-indole-5-carboximidamide
CID 165097178
5-(benzenesulfonyl)-2-phenyl-1H-indole
CID 21432981
1-(5-amino-2-phenyl-1H-indol-4-yl)ethanone
CID 23402126
2-(3-carbamimidoylphenyl)-1H-indole-5-carboximidamide
CID 3010563
N,N,2-triphenyl-1H-indol-5-amine
CID 154936544

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenyl-1H-indol-5-yl)ethanone?
The IUPAC name of 1-(2-phenyl-1H-indol-5-yl)ethanone (CID 44542857) is 1-(2-phenyl-1H-indol-5-yl)ethanone.
What is the SMILES notation for 1-(2-phenyl-1H-indol-5-yl)ethanone?
The canonical SMILES for 1-(2-phenyl-1H-indol-5-yl)ethanone is CC(=O)c1ccc2[nH]c(-c3ccccc3)cc2c1.
What is the InChIKey of 1-(2-phenyl-1H-indol-5-yl)ethanone?
The InChIKey is NPSOXGMUSDOEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c1-11(18)13-7-8-15-14(9-13)10-16(17-15)12-5-3-2-4-6-12/h2-10,17H,1H3.
What are the key properties of 1-(2-phenyl-1H-indol-5-yl)ethanone?
1-(2-phenyl-1H-indol-5-yl)ethanone has a molecular weight of 235.29 g/mol, XLogP of 4.04, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenyl-1H-indol-5-yl)ethanone is sourced from PubChem (CID 44542857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).