[4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone

C19H20N2O — CID 4256394

IUPAC[4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone
SMILESCCN(CC)c1ccc(C(=O)c2c[nH]c3ccccc23)cc1
InChIInChI=1S/C19H20N2O/c1-3-21(4-2)15-11-9-14(10-12-15)19(22)17-13-20-18-8-6-5-7-16(17)18/h5-13,20H,3-4H2,1-2H3
InChIKeySTTMTFPPJPKVMG-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.25
Rot. Bonds5

About [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone

[4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone (PubChem CID 4256394) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone.

Molecular Properties

Compound Name[4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone
PubChem CID4256394
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name[4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone
SMILESCCN(CC)c1ccc(C(=O)c2c[nH]c3ccccc23)cc1
InChIInChI=1S/C19H20N2O/c1-3-21(4-2)15-11-9-14(10-12-15)19(22)17-13-20-18-8-6-5-7-16(17)18/h5-13,20H,3-4H2,1-2H3
InChIKeySTTMTFPPJPKVMG-UHFFFAOYSA-N
XLogP4.25
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl] 4-(diethylamino)benzoate
CID 2083622
1H-indol-3-yl-(4-iodophenyl)methanone
CID 43339241
methyl 4-(1H-indole-3-carbonyl)benzoate
CID 139561809
N-ethyl-N-(4-fluorophenyl)-1H-indole-3-carboxamide
CID 60661185
2-[4-(diethylamino)-2-methylanilino]-1-(1H-indol-3-yl)ethanone
CID 110655324
N-[3-(N-ethylanilino)propyl]-2-(1H-indol-3-yl)-2-oxoacetamide
CID 7087100
[4-[2-[di(propan-2-yl)amino]ethoxy]phenyl]-(1H-indol-3-yl)methanone
CID 86147532
ethyl 3-benzoyl-1H-indole-5-carboxylate
CID 10589798
2-[[5-[4-(diethylamino)phenyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-(1H-indol-3-yl)ethanone
CID 30309363
3-(diethylamino)-1-(1H-indol-3-yl)propan-1-one
CID 53414703
1,3-benzodioxol-5-yl(1H-indol-3-yl)methanone
CID 43161266
bis[4-(diethylamino)phenyl]methanone;bis[4-(dimethylamino)phenyl]methanone;diphenylmethanone
CID 161451495

Frequently Asked Questions

What is the IUPAC name of [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone?
The IUPAC name of [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone (CID 4256394) is [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone.
What is the SMILES notation for [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone?
The canonical SMILES for [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone is CCN(CC)c1ccc(C(=O)c2c[nH]c3ccccc23)cc1.
What is the InChIKey of [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone?
The InChIKey is STTMTFPPJPKVMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-3-21(4-2)15-11-9-14(10-12-15)19(22)17-13-20-18-8-6-5-7-16(17)18/h5-13,20H,3-4H2,1-2H3.
What are the key properties of [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone?
[4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone has a molecular weight of 292.38 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(diethylamino)phenyl]-(1H-indol-3-yl)methanone is sourced from PubChem (CID 4256394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).