[1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone

C23H30N2O2 — CID 45486239

IUPAC[1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone
SMILESO=C(c1cn(CCN2CCOCC2)c2ccccc12)C1CC12CCCCC2
InChIInChI=1S/C23H30N2O2/c26-22(20-16-23(20)8-4-1-5-9-23)19-17-25(21-7-3-2-6-18(19)21)11-10-24-12-14-27-15-13-24/h2-3,6-7,17,20H,1,4-5,8-16H2
InChIKeyMUBBINBGCICILP-UHFFFAOYSA-N
MW366.51 g/mol
LogP4.13
Rot. Bonds5

About [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone

[1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone (PubChem CID 45486239) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone.

Molecular Properties

Compound Name[1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone
PubChem CID45486239
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC Name[1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone
SMILESO=C(c1cn(CCN2CCOCC2)c2ccccc12)C1CC12CCCCC2
InChIInChI=1S/C23H30N2O2/c26-22(20-16-23(20)8-4-1-5-9-23)19-17-25(21-7-3-2-6-18(19)21)11-10-24-12-14-27-15-13-24/h2-3,6-7,17,20H,1,4-5,8-16H2
InChIKeyMUBBINBGCICILP-UHFFFAOYSA-N
XLogP4.13
TPSA34.47 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[1-[2-(azepan-1-yl)ethyl]indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 11537904
(2-fluorophenyl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
CID 14896529
(4-fluorophenyl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
CID 170857357
[1-[2-(4-methylpiperazin-1-yl)ethyl]indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 11559687
[1-(2-morpholin-4-ylethyl)indol-3-yl]methanamine
CID 66407723
4-[1-(2-morpholin-4-ylethyl)indole-3-carbonyl]naphthalene-1-carbonitrile
CID 11742248
2-[1-(2-piperidin-1-ylethyl)indol-3-yl]acetic acid
CID 28783033
N-[(3R,5S)-3,5-dimethyl-1-adamantyl]-1-(2-morpholin-4-ylethyl)-4-oxoquinoline-3-carboxamide
CID 23634778
[1-(2-morpholin-4-ylethyl)indol-3-yl]-quinolin-6-ylmethanone
CID 10452672
(3-isothiocyanatonaphthalen-1-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
CID 10503315
2-morpholin-4-ylethyl 1-(2-morpholin-4-ylethyl)-3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indole-7-carboxylate
CID 11569778
morpholin-4-yl-[1-[2-(2-phenylcyclopropyl)ethyl]indol-3-yl]methanone
CID 178132738

Frequently Asked Questions

What is the IUPAC name of [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone?
The IUPAC name of [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone (CID 45486239) is [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone.
What is the SMILES notation for [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone?
The canonical SMILES for [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone is O=C(c1cn(CCN2CCOCC2)c2ccccc12)C1CC12CCCCC2.
What is the InChIKey of [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone?
The InChIKey is MUBBINBGCICILP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c26-22(20-16-23(20)8-4-1-5-9-23)19-17-25(21-7-3-2-6-18(19)21)11-10-24-12-14-27-15-13-24/h2-3,6-7,17,20H,1,4-5,8-16H2.
What are the key properties of [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone?
[1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone has a molecular weight of 366.51 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-morpholin-4-ylethyl)indol-3-yl]-spiro[2.5]octan-2-ylmethanone is sourced from PubChem (CID 45486239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).