11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine

C16H22N2 — CID 67433990

IUPAC11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine
SMILESCc1ccc2c(c1)C1C(CCN3CCCCC13)N2
InChIInChI=1S/C16H22N2/c1-11-5-6-13-12(10-11)16-14(17-13)7-9-18-8-3-2-4-15(16)18/h5-6,10,14-17H,2-4,7-9H2,1H3
InChIKeyRAMVLMQLZWNAJR-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.13
Rot. Bonds

About 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine

11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine (PubChem CID 67433990) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine.

Molecular Properties

Compound Name11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine
PubChem CID67433990
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine
SMILESCc1ccc2c(c1)C1C(CCN3CCCCC13)N2
InChIInChI=1S/C16H22N2/c1-11-5-6-13-12(10-11)16-14(17-13)7-9-18-8-3-2-4-15(16)18/h5-6,10,14-17H,2-4,7-9H2,1H3
InChIKeyRAMVLMQLZWNAJR-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine?
The IUPAC name of 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine (CID 67433990) is 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine.
What is the SMILES notation for 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine?
The canonical SMILES for 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine is Cc1ccc2c(c1)C1C(CCN3CCCCC13)N2.
What is the InChIKey of 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine?
The InChIKey is RAMVLMQLZWNAJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-11-5-6-13-12(10-11)16-14(17-13)7-9-18-8-3-2-4-15(16)18/h5-6,10,14-17H,2-4,7-9H2,1H3.
What are the key properties of 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine?
11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine has a molecular weight of 242.37 g/mol, XLogP of 3.13, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-1,2,3,4,6,7,7a,8,12b,12c-decahydroindolo[3,2-a]quinolizine is sourced from PubChem (CID 67433990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).