6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one

C21H24N2O3 — CID 15982400

IUPAC6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one
SMILESCOc1ccc(CN2C(=O)C3(CCNCC3)c3ccc(OC)cc32)cc1
InChIInChI=1S/C21H24N2O3/c1-25-16-5-3-15(4-6-16)14-23-19-13-17(26-2)7-8-18(19)21(20(23)24)9-11-22-12-10-21/h3-8,13,22H,9-12,14H2,1-2H3
InChIKeyJFFZHAPIJPSPPS-UHFFFAOYSA-N
MW352.43 g/mol
LogP2.87
Rot. Bonds4

About 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one

6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one (PubChem CID 15982400) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one.

Molecular Properties

Compound Name6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one
PubChem CID15982400
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one
SMILESCOc1ccc(CN2C(=O)C3(CCNCC3)c3ccc(OC)cc32)cc1
InChIInChI=1S/C21H24N2O3/c1-25-16-5-3-15(4-6-16)14-23-19-13-17(26-2)7-8-18(19)21(20(23)24)9-11-22-12-10-21/h3-8,13,22H,9-12,14H2,1-2H3
InChIKeyJFFZHAPIJPSPPS-UHFFFAOYSA-N
XLogP2.87
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-methoxy-2-oxospiro[indole-3,4'-piperidine]-1-yl)ethyl acetate
CID 15982399
3-[(4-methoxyphenyl)methyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione;hydrochloride
CID 68626194
1-benzyl-6-methoxy-3,3-dimethylindol-2-one
CID 1201570
2-[(4-methoxyphenyl)methyl]-2,8-diazaspiro[4.5]decan-1-one;hydrochloride
CID 45074122
1'-benzyl-5'-methoxyspiro[cyclopropane-1,3'-indole]-2'-one;1H-indazole
CID 166128782
3-[(4-methoxyphenyl)methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 130201562
tert-butyl 1-benzyl-2-oxospiro[indole-3,4'-piperidine]-5-carboxylate
CID 68543344
1-[(3,4-dichlorophenyl)methyl]spiro[indole-3,3'-pyrrolidine]-2-one;hydrochloride
CID 155972674
1'-[(4-methoxyphenyl)methyl]spiro[cyclohexane-4,3'-pyrrolo[2,3-b]pyridine]-1,2'-dione
CID 169258334
(5'Z)-1-benzyl-5'-benzylidene-6-methoxyspiro[indole-3,2'-oxolane]-2-one
CID 54761735
1-(6-methoxy-1H-indole-2-carbonyl)spiro[indole-3,4'-piperidine]-2-one
CID 68815259
(3S)-1-benzyl-3-hydroxy-6-methoxy-3-phenacylindol-2-one
CID 72697841

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one?
The IUPAC name of 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one (CID 15982400) is 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one.
What is the SMILES notation for 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one?
The canonical SMILES for 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one is COc1ccc(CN2C(=O)C3(CCNCC3)c3ccc(OC)cc32)cc1.
What is the InChIKey of 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one?
The InChIKey is JFFZHAPIJPSPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-25-16-5-3-15(4-6-16)14-23-19-13-17(26-2)7-8-18(19)21(20(23)24)9-11-22-12-10-21/h3-8,13,22H,9-12,14H2,1-2H3.
What are the key properties of 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one?
6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one has a molecular weight of 352.43 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1-[(4-methoxyphenyl)methyl]spiro[indole-3,4'-piperidine]-2-one is sourced from PubChem (CID 15982400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).