[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone

C23H28N2O2 — CID 75455125

IUPAC[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone
SMILESCc1ccc(C)c(OC2CCN(C(=O)c3ccc4c(c3)N(C)CC4)CC2)c1
InChIInChI=1S/C23H28N2O2/c1-16-4-5-17(2)22(14-16)27-20-9-12-25(13-10-20)23(26)19-7-6-18-8-11-24(3)21(18)15-19/h4-7,14-15,20H,8-13H2,1-3H3
InChIKeyJWEAMQRHWWHMRA-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.98
Rot. Bonds3

About [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone

[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone (PubChem CID 75455125) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone.

Molecular Properties

Compound Name[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone
PubChem CID75455125
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC Name[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone
SMILESCc1ccc(C)c(OC2CCN(C(=O)c3ccc4c(c3)N(C)CC4)CC2)c1
InChIInChI=1S/C23H28N2O2/c1-16-4-5-17(2)22(14-16)27-20-9-12-25(13-10-20)23(26)19-7-6-18-8-11-24(3)21(18)15-19/h4-7,14-15,20H,8-13H2,1-3H3
InChIKeyJWEAMQRHWWHMRA-UHFFFAOYSA-N
XLogP3.98
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone 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-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methylimidazol-4-yl)methanone
CID 145375199
[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(2-hydroxycyclopentyl)methanone
CID 110014286
[4-(2,5-dimethylphenoxy)piperidin-1-yl]-spiro[2.5]octan-6-ylmethanone
CID 154877625
[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-hydroxycyclopentyl)methanone
CID 110907581
(1-methyl-2,3-dihydroindol-5-yl)-(4-methylpiperidin-1-yl)methanone
CID 110485530
(3,4-dimethoxyphenyl)-[4-(2,5-dimethylanilino)piperidin-1-yl]methanone
CID 3373464
N-[2-[4-(2,5-dimethylphenoxy)piperidin-1-yl]-2-oxoethyl]benzamide
CID 60574366
(2S)-2-[4-(2,5-dimethylphenoxy)piperidin-1-yl]propanamide
CID 94199164
[4-[2-methyl-5-(methylamino)phenoxy]piperidin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 137466986
2-amino-1-[4-(2,5-dimethylphenoxy)piperidin-1-yl]-2-methylpentan-1-one
CID 119748409
(2,5-dimethylphenyl)-[4-(1-methylpiperidin-4-yl)oxypiperidin-1-yl]methanone
CID 91916408
(1-methyl-2,3-dihydroindol-5-yl)-(4-methylpiperazin-1-yl)methanone
CID 110485510

Frequently Asked Questions

What is the IUPAC name of [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone?
The IUPAC name of [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone (CID 75455125) is [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone.
What is the SMILES notation for [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone?
The canonical SMILES for [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone is Cc1ccc(C)c(OC2CCN(C(=O)c3ccc4c(c3)N(C)CC4)CC2)c1.
What is the InChIKey of [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone?
The InChIKey is JWEAMQRHWWHMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-16-4-5-17(2)22(14-16)27-20-9-12-25(13-10-20)23(26)19-7-6-18-8-11-24(3)21(18)15-19/h4-7,14-15,20H,8-13H2,1-3H3.
What are the key properties of [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone?
[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone has a molecular weight of 364.49 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methyl-2,3-dihydroindol-6-yl)methanone is sourced from PubChem (CID 75455125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).