1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone

C22H27N3O3 — CID 90181061

IUPAC1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone
SMILESCc1ncccc1OC[C@H]1CN(CC(=O)N2c3ccccc3CC2C)CCO1
InChIInChI=1S/C22H27N3O3/c1-16-12-18-6-3-4-7-20(18)25(16)22(26)14-24-10-11-27-19(13-24)15-28-21-8-5-9-23-17(21)2/h3-9,16,19H,10-15H2,1-2H3/t16?,19-/m1/s1
InChIKeyCOXVGVOSFMXIOC-LRTDYKAYSA-N
MW381.48 g/mol
LogP2.45
Rot. Bonds5

About 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone

1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone (PubChem CID 90181061) has the molecular formula C22H27N3O3 and a molecular weight of 381.48 g/mol. Its IUPAC name is 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone.

Molecular Properties

Compound Name1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone
PubChem CID90181061
Molecular FormulaC22H27N3O3
Molecular Weight381.48 g/mol
Exact Mass381.21
IUPAC Name1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone
SMILESCc1ncccc1OC[C@H]1CN(CC(=O)N2c3ccccc3CC2C)CCO1
InChIInChI=1S/C22H27N3O3/c1-16-12-18-6-3-4-7-20(18)25(16)22(26)14-24-10-11-27-19(13-24)15-28-21-8-5-9-23-17(21)2/h3-9,16,19H,10-15H2,1-2H3/t16?,19-/m1/s1
InChIKeyCOXVGVOSFMXIOC-LRTDYKAYSA-N
XLogP2.45
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone 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

4-methyl-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholine
CID 70907046
1-(2,3-dihydroindol-1-yl)-2-[(2R)-2-(pyridin-3-yloxymethyl)morpholin-4-yl]ethanone
CID 71062530
1-(2-methyl-2,3-dihydroindol-1-yl)-2-[4-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-1,4-diazepan-1-yl]ethanone
CID 3438367
2-(3-aminopyrrolidin-1-yl)-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 62068343
1-(2-methyl-2,3-dihydroindol-1-yl)-2-(2-methylphenoxy)ethanone
CID 19798381
1-(2-methyl-2,3-dihydroindol-1-yl)-2-(4-methylpiperidin-1-yl)ethanone
CID 5296275
2-[(2R)-2-[(2-methoxyphenoxy)methyl]morpholin-4-yl]acetamide
CID 99979589
methyl 2-[2-[(2-methoxyphenoxy)methyl]morpholin-4-yl]acetate
CID 102567692
1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-2-[4-(morpholine-4-carbonyl)piperazin-1-yl]ethanone
CID 41325271
methyl 2-[(2R)-2-[(2-bromophenoxy)methyl]morpholin-4-yl]acetate
CID 99979761
1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2-nitro-3-pyridinyl)oxy]ethanone
CID 3257964
1,2-bis(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 73142226

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone?
The IUPAC name of 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone (CID 90181061) is 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone.
What is the SMILES notation for 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone?
The canonical SMILES for 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone is Cc1ncccc1OC[C@H]1CN(CC(=O)N2c3ccccc3CC2C)CCO1.
What is the InChIKey of 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone?
The InChIKey is COXVGVOSFMXIOC-LRTDYKAYSA-N. The full InChI is InChI=1S/C22H27N3O3/c1-16-12-18-6-3-4-7-20(18)25(16)22(26)14-24-10-11-27-19(13-24)15-28-21-8-5-9-23-17(21)2/h3-9,16,19H,10-15H2,1-2H3/t16?,19-/m1/s1.
What are the key properties of 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone?
1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone has a molecular weight of 381.48 g/mol, XLogP of 2.45, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(2R)-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]ethanone is sourced from PubChem (CID 90181061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).