1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]

C20H21N3 — CID 57030538

IUPAC1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]
SMILESCN1CCC2(CC1)N=C1CC=CCC1=C1N=c3ccccc3=C12
InChIInChI=1S/C20H21N3/c1-23-12-10-20(11-13-23)18-14-6-2-4-8-16(14)21-19(18)15-7-3-5-9-17(15)22-20/h2-6,8H,7,9-13H2,1H3
InChIKeyYEVSSVSFLWQUFR-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.99
Rot. Bonds

About 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]

1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine] (PubChem CID 57030538) has the molecular formula C20H21N3 and a molecular weight of 303.41 g/mol. Its IUPAC name is 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine].

Molecular Properties

Compound Name1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]
PubChem CID57030538
Molecular FormulaC20H21N3
Molecular Weight303.41 g/mol
Exact Mass303.17
IUPAC Name1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]
SMILESCN1CCC2(CC1)N=C1CC=CCC1=C1N=c3ccccc3=C12
InChIInChI=1S/C20H21N3/c1-23-12-10-20(11-13-23)18-14-6-2-4-8-16(14)21-19(18)15-7-3-5-9-17(15)22-20/h2-6,8H,7,9-13H2,1H3
InChIKeyYEVSSVSFLWQUFR-UHFFFAOYSA-N
XLogP1.99
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Hexahydroindolo[2,3-a]quinolizine
CID 18963250
2-fluoro-1',5-dimethylspiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824927
3-fluoro-1',5-dimethylspiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824930
1',5-dimethyl-3-(trifluoromethyl)spiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824940
9-Methyloctahydroindolo[2,3-a]quinolizine
CID 129734677
Hexamethyl-dihydrodipyrrolonaphthalene
CID 129873981
1',5-dimethyl-3-methylsulfanylspiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824919
1'-Ethyl-5,6-dihydrospiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824921
1',5-dimethyl-8-methylsulfanylspiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824922
1'-Propylspiro[1,5-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824924
3-chloro-1',5-dimethylspiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine];dihydrochloride
CID 19824928
3-chloro-1',5-dimethylspiro[1H-indolo[3,2-c]quinoline-6,4'-piperidine]
CID 19824929

Frequently Asked Questions

What is the IUPAC name of 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]?
The IUPAC name of 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine] (CID 57030538) is 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine].
What is the SMILES notation for 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]?
The canonical SMILES for 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine] is CN1CCC2(CC1)N=C1CC=CCC1=C1N=c3ccccc3=C12.
What is the InChIKey of 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]?
The InChIKey is YEVSSVSFLWQUFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3/c1-23-12-10-20(11-13-23)18-14-6-2-4-8-16(14)21-19(18)15-7-3-5-9-17(15)22-20/h2-6,8H,7,9-13H2,1H3.
What are the key properties of 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine]?
1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine] has a molecular weight of 303.41 g/mol, XLogP of 1.99, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-methylspiro[1,4-dihydroindolo[3,2-c]quinoline-6,4'-piperidine] is sourced from PubChem (CID 57030538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).