2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone

C18H19NO — CID 116593600

IUPAC2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone
SMILESCCc1ccc(C(=O)CC2CNc3ccccc32)cc1
InChIInChI=1S/C18H19NO/c1-2-13-7-9-14(10-8-13)18(20)11-15-12-19-17-6-4-3-5-16(15)17/h3-10,15,19H,2,11-12H2,1H3
InChIKeyMFXJCQCSIWXLAP-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.03
Rot. Bonds4

About 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone

2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone (PubChem CID 116593600) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone
PubChem CID116593600
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone
SMILESCCc1ccc(C(=O)CC2CNc3ccccc32)cc1
InChIInChI=1S/C18H19NO/c1-2-13-7-9-14(10-8-13)18(20)11-15-12-19-17-6-4-3-5-16(15)17/h3-10,15,19H,2,11-12H2,1H3
InChIKeyMFXJCQCSIWXLAP-UHFFFAOYSA-N
XLogP4.03
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydro-1H-indol-3-yl)-1-(2-methoxyphenyl)ethanone
CID 116593595
propyl 2-(2,3-dihydro-1H-indol-3-yl)acetate
CID 79600080
N-(2,3-dihydro-1H-indol-3-ylmethyl)-4-ethyl-N-methylaniline
CID 80566627
1-(cyclohepten-1-yl)-2-(2,3-dihydro-1H-indol-3-yl)ethanone
CID 106655553
(3R)-3-ethyl-2,3-dihydro-1H-indole
CID 92797412
1-(4-bromophenyl)-3-(2,3-dihydro-1H-indol-3-yl)propan-2-one
CID 116593523
2-(2,3-dihydro-1H-indol-3-yl)-1-(2-propylpyrazol-3-yl)ethanone
CID 116593479
2-(2,3-dihydro-1H-indol-3-yl)-N',N'-dimethylacetohydrazide
CID 83020755
2-(2,3-dihydro-1H-indol-3-yl)-N-methyl-N-pentan-3-ylacetamide
CID 80573144
2-(2,3-dihydro-1H-indol-3-yl)-N-ethyl-N-phenylacetamide
CID 80572173
1-(3-chlorothiophen-2-yl)-2-(2,3-dihydro-1H-indol-3-yl)ethanone
CID 107361507
2-(2,3-dihydro-1H-indol-3-yl)-N-pentylacetamide
CID 80573792

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone?
The IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone (CID 116593600) is 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone is CCc1ccc(C(=O)CC2CNc3ccccc32)cc1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone?
The InChIKey is MFXJCQCSIWXLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-2-13-7-9-14(10-8-13)18(20)11-15-12-19-17-6-4-3-5-16(15)17/h3-10,15,19H,2,11-12H2,1H3.
What are the key properties of 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone?
2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone has a molecular weight of 265.36 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-3-yl)-1-(4-ethylphenyl)ethanone is sourced from PubChem (CID 116593600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).