[4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone

C19H20N2O — CID 11833220

IUPAC[4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone
SMILESCN(C)CCc1cccc2[nH]c(C(=O)c3ccccc3)cc12
InChIInChI=1S/C19H20N2O/c1-21(2)12-11-14-9-6-10-17-16(14)13-18(20-17)19(22)15-7-4-3-5-8-15/h3-10,13,20H,11-12H2,1-2H3
InChIKeyAMEZLRKIJOOPNJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.50
Rot. Bonds5

About [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone

[4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone (PubChem CID 11833220) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone.

Molecular Properties

Compound Name[4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone
PubChem CID11833220
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name[4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone
SMILESCN(C)CCc1cccc2[nH]c(C(=O)c3ccccc3)cc12
InChIInChI=1S/C19H20N2O/c1-21(2)12-11-14-9-6-10-17-16(14)13-18(20-17)19(22)15-7-4-3-5-8-15/h3-10,13,20H,11-12H2,1-2H3
InChIKeyAMEZLRKIJOOPNJ-UHFFFAOYSA-N
XLogP3.50
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 ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone?
The IUPAC name of [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone (CID 11833220) is [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone.
What is the SMILES notation for [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone?
The canonical SMILES for [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone is CN(C)CCc1cccc2[nH]c(C(=O)c3ccccc3)cc12.
What is the InChIKey of [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone?
The InChIKey is AMEZLRKIJOOPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-21(2)12-11-14-9-6-10-17-16(14)13-18(20-17)19(22)15-7-4-3-5-8-15/h3-10,13,20H,11-12H2,1-2H3.
What are the key properties of [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone?
[4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone has a molecular weight of 292.38 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(dimethylamino)ethyl]-1H-indol-2-yl]-phenylmethanone is sourced from PubChem (CID 11833220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).