1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole

C21H26N4O2 — CID 126952243

IUPAC1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole
SMILESCOCCn1ccc2c(OC3CCN(c4nccnc4C)CC3)cccc21
InChIInChI=1S/C21H26N4O2/c1-16-21(23-10-9-22-16)25-11-6-17(7-12-25)27-20-5-3-4-19-18(20)8-13-24(19)14-15-26-2/h3-5,8-10,13,17H,6-7,11-12,14-15H2,1-2H3
InChIKeyVWNLZTYCPVJKCP-UHFFFAOYSA-N
MW366.47 g/mol
LogP3.43
Rot. Bonds6

About 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole

1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole (PubChem CID 126952243) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole
PubChem CID126952243
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC Name1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole
SMILESCOCCn1ccc2c(OC3CCN(c4nccnc4C)CC3)cccc21
InChIInChI=1S/C21H26N4O2/c1-16-21(23-10-9-22-16)25-11-6-17(7-12-25)27-20-5-3-4-19-18(20)8-13-24(19)14-15-26-2/h3-5,8-10,13,17H,6-7,11-12,14-15H2,1-2H3
InChIKeyVWNLZTYCPVJKCP-UHFFFAOYSA-N
XLogP3.43
TPSA52.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-methoxyethyl)-4-(1-pyrimidin-4-ylpiperidin-4-yl)oxyindole
CID 126952266
4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxy-1-(oxolan-3-yl)indole
CID 126953211
6-[4-[1-(cyclopropylmethyl)indol-4-yl]oxypiperidin-1-yl]-2-methylpyridazin-3-one
CID 126952470
2-[4-[1-(5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]oxyindol-1-yl]acetamide
CID 126953562
1-(2-methoxyethyl)-4-pyridin-2-ylindole
CID 141303499
2-[4-[1-(1-methyl-6-oxopyrimidin-4-yl)piperidin-4-yl]oxyindol-1-yl]acetamide
CID 126953596
1-methyl-4-(1-methylpiperidin-4-yl)oxyindole
CID 126952178
1-methyl-4-[4-(1-methylindol-4-yl)oxypiperidin-1-yl]pyrazolo[5,4-d]pyrimidine
CID 126951941
2-[4-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxyindol-1-yl]acetamide
CID 126953392
N-cyclooctyl-2-[1-(2-methoxyethyl)indol-4-yl]oxyacetamide
CID 121239263
6-[4-[1-(2,2-difluoroethyl)indol-4-yl]oxypiperidin-1-yl]-2,5-dimethylpyrazolo[3,4-d]pyrimidin-4-one
CID 126952953
4-[[4-[1-(cyclopropylmethyl)indol-4-yl]oxypiperidin-1-yl]methyl]-1,3-oxazole
CID 126952428

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole?
The IUPAC name of 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole (CID 126952243) is 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole.
What is the SMILES notation for 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole?
The canonical SMILES for 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole is COCCn1ccc2c(OC3CCN(c4nccnc4C)CC3)cccc21.
What is the InChIKey of 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole?
The InChIKey is VWNLZTYCPVJKCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-16-21(23-10-9-22-16)25-11-6-17(7-12-25)27-20-5-3-4-19-18(20)8-13-24(19)14-15-26-2/h3-5,8-10,13,17H,6-7,11-12,14-15H2,1-2H3.
What are the key properties of 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole?
1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole has a molecular weight of 366.47 g/mol, XLogP of 3.43, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4-[1-(3-methylpyrazin-2-yl)piperidin-4-yl]oxyindole is sourced from PubChem (CID 126952243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).