1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]

C17H22N2 — CID 22896575

IUPAC1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]
SMILESCN1CCC2(CCc3c2n(C)c2ccccc32)CC1
InChIInChI=1S/C17H22N2/c1-18-11-9-17(10-12-18)8-7-14-13-5-3-4-6-15(13)19(2)16(14)17/h3-6H,7-12H2,1-2H3
InChIKeyRCTLGJUGOCVRTL-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.09
Rot. Bonds

About 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]

1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine] (PubChem CID 22896575) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine].

Molecular Properties

Compound Name1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]
PubChem CID22896575
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]
SMILESCN1CCC2(CCc3c2n(C)c2ccccc32)CC1
InChIInChI=1S/C17H22N2/c1-18-11-9-17(10-12-18)8-7-14-13-5-3-4-6-15(13)19(2)16(14)17/h3-6H,7-12H2,1-2H3
InChIKeyRCTLGJUGOCVRTL-UHFFFAOYSA-N
XLogP3.09
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine] with MolForge

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Related Compounds

4-methyl-3,3-diphenyl-1,2-dihydrocyclopenta[b]indole
CID 3692587
1,1,9-trimethyl-3,4-dihydro-2H-pyrido[3,4-b]indole
CID 82393965
2,5-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indole
CID 674261
12,21-dimethyl-12,21-diazatetracyclo[12.7.0.04,9.015,20]henicosa-1(14),4,6,8,15,17,19-heptaene
CID 122365826
3-[(1R)-1,9-dimethyl-3,4-dihydro-2H-carbazol-1-yl]propanoic acid
CID 129405053
1'-methylspiro[3,4-dihydronaphthalene-2,4'-piperidine]-1-one
CID 10263215
2,9-dimethyl-3,4-dihydrocarbazole
CID 149373411
4-methyl-3-(4-methylphenyl)sulfonyl-1,2-dihydropyrrolo[2,3-b]indole
CID 134957407
17-methyl-17-azatetracyclo[12.5.0.02,7.08,13]nonadeca-1(14),2,4,6,8,10,12-heptaene
CID 12566036
ethane;4-ethyl-3,3-dimethyl-1,2-dihydrocyclopenta[b]indole
CID 158823600
4-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]indole
CID 82411813
ethane;bis(9-methylcarbazole)
CID 159710949

Frequently Asked Questions

What is the IUPAC name of 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]?
The IUPAC name of 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine] (CID 22896575) is 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine].
What is the SMILES notation for 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]?
The canonical SMILES for 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine] is CN1CCC2(CCc3c2n(C)c2ccccc32)CC1.
What is the InChIKey of 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]?
The InChIKey is RCTLGJUGOCVRTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-18-11-9-17(10-12-18)8-7-14-13-5-3-4-6-15(13)19(2)16(14)17/h3-6H,7-12H2,1-2H3.
What are the key properties of 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine]?
1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine] has a molecular weight of 254.38 g/mol, XLogP of 3.09, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1',4-dimethylspiro[1,2-dihydrocyclopenta[b]indole-3,4'-piperidine] is sourced from PubChem (CID 22896575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).