2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide

C22H25ClN2O — CID 10090458

IUPAC2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1c(-c2cccc(Cl)c2)[nH]c2ccccc12
InChIInChI=1S/C22H25ClN2O/c1-3-12-25(13-4-2)21(26)15-19-18-10-5-6-11-20(18)24-22(19)16-8-7-9-17(23)14-16/h5-11,14,24H,3-4,12-13,15H2,1-2H3
InChIKeyIQCAEPRFTVJTSV-UHFFFAOYSA-N
MW368.91 g/mol
LogP5.68
Rot. Bonds7

About 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide

2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide (PubChem CID 10090458) has the molecular formula C22H25ClN2O and a molecular weight of 368.91 g/mol. Its IUPAC name is 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide
PubChem CID10090458
Molecular FormulaC22H25ClN2O
Molecular Weight368.91 g/mol
Exact Mass368.17
IUPAC Name2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)Cc1c(-c2cccc(Cl)c2)[nH]c2ccccc12
InChIInChI=1S/C22H25ClN2O/c1-3-12-25(13-4-2)21(26)15-19-18-10-5-6-11-20(18)24-22(19)16-8-7-9-17(23)14-16/h5-11,14,24H,3-4,12-13,15H2,1-2H3
InChIKeyIQCAEPRFTVJTSV-UHFFFAOYSA-N
XLogP5.68
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.91
LogP ≤ 55.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

EX 527
CID 5113032
Jnj-7777120
CID 4908365
Luzindole
CID 122162
2-(4-Fluorophenyl)-N,N-dihexyl-1H-indole-3-acetamide
CID 132496
CK-666
CID 589075
ST-1936
CID 9921064
Org27569
CID 44828492
(6S)-2-Chloro-5,6,7,8,9,10-hexahydro-cyclohept[b]indole-6-carboxamide
CID 914268
3-(4-fluorophenylethylamino)-1-methyl-4-(2-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione
CID 25209788
6-Chloro-2,3,4,9-tetrahydro-1H-carbazol-1-one
CID 612977
(1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
CID 707029
Bas 05212031
CID 795532

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide?
The IUPAC name of 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide (CID 10090458) is 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide?
The canonical SMILES for 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide is CCCN(CCC)C(=O)Cc1c(-c2cccc(Cl)c2)[nH]c2ccccc12.
What is the InChIKey of 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide?
The InChIKey is IQCAEPRFTVJTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25ClN2O/c1-3-12-25(13-4-2)21(26)15-19-18-10-5-6-11-20(18)24-22(19)16-8-7-9-17(23)14-16/h5-11,14,24H,3-4,12-13,15H2,1-2H3.
What are the key properties of 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide?
2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide has a molecular weight of 368.91 g/mol, XLogP of 5.68, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-chlorophenyl)-1H-indol-3-yl]-N,N-dipropylacetamide is sourced from PubChem (CID 10090458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).