N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide

C22H21N3O2 — CID 113016604

IUPACN-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(N3CCc4ccccc43)nc2)cc1
InChIInChI=1S/C22H21N3O2/c1-16-6-9-19(10-7-16)27-15-22(26)24-18-8-11-21(23-14-18)25-13-12-17-4-2-3-5-20(17)25/h2-11,14H,12-13,15H2,1H3,(H,24,26)
InChIKeyXTUMZDOJCFLZNO-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.10
Rot. Bonds5

About N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide

N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide (PubChem CID 113016604) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
PubChem CID113016604
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC NameN-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(N3CCc4ccccc43)nc2)cc1
InChIInChI=1S/C22H21N3O2/c1-16-6-9-19(10-7-16)27-15-22(26)24-18-8-11-21(23-14-18)25-13-12-17-4-2-3-5-20(17)25/h2-11,14H,12-13,15H2,1H3,(H,24,26)
InChIKeyXTUMZDOJCFLZNO-UHFFFAOYSA-N
XLogP4.10
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide 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

N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-3-phenoxypropanamide
CID 113016596
2-(4-chlorophenoxy)-N-[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridinyl]acetamide
CID 113013135
N-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 113014078
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]acetamide
CID 122299107
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109162480
1-[5-(dimethylsulfamoylamino)-2-pyridinyl]-2,3-dihydroindole
CID 113016627
2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 3160208
3-chloro-N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzamide
CID 113016598
5-(2,3-dihydroindol-1-yl)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109290512
N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]oxolane-2-carboxamide
CID 113016563
2-(4-phenylmethoxyphenoxy)-N-(6-pyrrolidin-1-yl-3-pyridinyl)acetamide
CID 134035859

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide (CID 113016604) is N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide is Cc1ccc(OCC(=O)Nc2ccc(N3CCc4ccccc43)nc2)cc1.
What is the InChIKey of N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide?
The InChIKey is XTUMZDOJCFLZNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c1-16-6-9-19(10-7-16)27-15-22(26)24-18-8-11-21(23-14-18)25-13-12-17-4-2-3-5-20(17)25/h2-11,14H,12-13,15H2,1H3,(H,24,26).
What are the key properties of N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide?
N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide has a molecular weight of 359.43 g/mol, XLogP of 4.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 113016604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).