1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine

C20H26N2O — CID 141013903

IUPAC1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine
SMILESCCC1=C2c3[nH]c4cc(CC)ccc4c3CC(OC)N2CCC1
InChIInChI=1S/C20H26N2O/c1-4-13-8-9-15-16-12-18(23-3)22-10-6-7-14(5-2)20(22)19(16)21-17(15)11-13/h8-9,11,18,21H,4-7,10,12H2,1-3H3
InChIKeyHKQPHPNEEDRYJU-UHFFFAOYSA-N
MW310.44 g/mol
LogP4.48
Rot. Bonds3

About 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine

1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine (PubChem CID 141013903) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine.

Molecular Properties

Compound Name1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine
PubChem CID141013903
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine
SMILESCCC1=C2c3[nH]c4cc(CC)ccc4c3CC(OC)N2CCC1
InChIInChI=1S/C20H26N2O/c1-4-13-8-9-15-16-12-18(23-3)22-10-6-7-14(5-2)20(22)19(16)21-17(15)11-13/h8-9,11,18,21H,4-7,10,12H2,1-3H3
InChIKeyHKQPHPNEEDRYJU-UHFFFAOYSA-N
XLogP4.48
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine with MolForge

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Related Compounds

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1-butyl-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine
CID 21399518
8-(diethylaminomethyl)-1-methyl-2,3,4,6-tetrahydrobenzo[h][1,6]naphthyridin-5-one
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CID 56950085
(6-ethyl-2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl)methanamine
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1,3-bis(ethenyl)pyrrolidin-2-one;2-ethyl-9H-carbazole
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6-ethyl-2,3,4,9-tetrahydro-1H-carbazol-3-amine
CID 82275010
3-ethyl-5H-naphtho[2,3-c]carbazole
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2-benzyl-1-methyl-7-propyl-1,3,4,9-tetrahydropyrido[3,4-b]indole
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Frequently Asked Questions

What is the IUPAC name of 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine?
The IUPAC name of 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine (CID 141013903) is 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine.
What is the SMILES notation for 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine?
The canonical SMILES for 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine is CCC1=C2c3[nH]c4cc(CC)ccc4c3CC(OC)N2CCC1.
What is the InChIKey of 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine?
The InChIKey is HKQPHPNEEDRYJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-4-13-8-9-15-16-12-18(23-3)22-10-6-7-14(5-2)20(22)19(16)21-17(15)11-13/h8-9,11,18,21H,4-7,10,12H2,1-3H3.
What are the key properties of 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine?
1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine has a molecular weight of 310.44 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,10-diethyl-6-methoxy-2,3,4,6,7,12-hexahydroindolo[2,3-a]quinolizine is sourced from PubChem (CID 141013903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).