7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]

C24H27N3O — CID 70814251

IUPAC7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]
SMILESCOc1ccc2c(c1)NC1(CCN(C(C)c3ccccc3)CC1)c1cccn1-2
InChIInChI=1S/C24H27N3O/c1-18(19-7-4-3-5-8-19)26-15-12-24(13-16-26)23-9-6-14-27(23)22-11-10-20(28-2)17-21(22)25-24/h3-11,14,17-18,25H,12-13,15-16H2,1-2H3
InChIKeyARUDLDFJAUBQCT-UHFFFAOYSA-N
MW373.50 g/mol
LogP4.96
Rot. Bonds3

About 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]

7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine] (PubChem CID 70814251) has the molecular formula C24H27N3O and a molecular weight of 373.50 g/mol. Its IUPAC name is 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine].

Molecular Properties

Compound Name7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]
PubChem CID70814251
Molecular FormulaC24H27N3O
Molecular Weight373.50 g/mol
Exact Mass373.22
IUPAC Name7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]
SMILESCOc1ccc2c(c1)NC1(CCN(C(C)c3ccccc3)CC1)c1cccn1-2
InChIInChI=1S/C24H27N3O/c1-18(19-7-4-3-5-8-19)26-15-12-24(13-16-26)23-9-6-14-27(23)22-11-10-20(28-2)17-21(22)25-24/h3-11,14,17-18,25H,12-13,15-16H2,1-2H3
InChIKeyARUDLDFJAUBQCT-UHFFFAOYSA-N
XLogP4.96
TPSA29.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine] with MolForge

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Related Compounds

1'-benzylsulfonyl-7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]
CID 53025766
1'-(2-chlorophenyl)sulfonyl-7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]
CID 53025780
cyclopentyl-(7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-yl)methanone
CID 53058204
1-[4-(7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-carbonyl)phenyl]ethanone
CID 70814248
(4-chlorophenyl)-(7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-yl)methanone
CID 53058100
1'-(3,4-dichlorophenyl)sulfonyl-7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]
CID 53025786
7-methoxy-1'-(2,4,6-trimethylphenyl)sulfonylspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]
CID 53025757
7-methoxy-N-(3-methoxyphenyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-carboxamide
CID 53008766
N-(3,5-dimethylphenyl)-7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-carboxamide
CID 53030239
N-(3-chloro-4-methylphenyl)-7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-carboxamide
CID 53030235
CID 110212525
CID 110212525
(3-fluoro-4-methylphenyl)-(7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-yl)methanone
CID 53058114

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]?
The IUPAC name of 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine] (CID 70814251) is 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine].
What is the SMILES notation for 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]?
The canonical SMILES for 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine] is COc1ccc2c(c1)NC1(CCN(C(C)c3ccccc3)CC1)c1cccn1-2.
What is the InChIKey of 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]?
The InChIKey is ARUDLDFJAUBQCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O/c1-18(19-7-4-3-5-8-19)26-15-12-24(13-16-26)23-9-6-14-27(23)22-11-10-20(28-2)17-21(22)25-24/h3-11,14,17-18,25H,12-13,15-16H2,1-2H3.
What are the key properties of 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]?
7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine] has a molecular weight of 373.50 g/mol, XLogP of 4.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1'-(1-phenylethyl)spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine] is sourced from PubChem (CID 70814251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).