1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline

C13H21NO — CID 146658784

IUPAC1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline
SMILESCCN1CCCC2=C1C(C)CC(OC)=C2
InChIInChI=1S/C13H21NO/c1-4-14-7-5-6-11-9-12(15-3)8-10(2)13(11)14/h9-10H,4-8H2,1-3H3
InChIKeyWBBLGFITNNNWBS-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.93
Rot. Bonds2

About 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline

1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline (PubChem CID 146658784) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline.

Molecular Properties

Compound Name1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline
PubChem CID146658784
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline
SMILESCCN1CCCC2=C1C(C)CC(OC)=C2
InChIInChI=1S/C13H21NO/c1-4-14-7-5-6-11-9-12(15-3)8-10(2)13(11)14/h9-10H,4-8H2,1-3H3
InChIKeyWBBLGFITNNNWBS-UHFFFAOYSA-N
XLogP2.93
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline?
The IUPAC name of 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline (CID 146658784) is 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline.
What is the SMILES notation for 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline?
The canonical SMILES for 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline is CCN1CCCC2=C1C(C)CC(OC)=C2.
What is the InChIKey of 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline?
The InChIKey is WBBLGFITNNNWBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-4-14-7-5-6-11-9-12(15-3)8-10(2)13(11)14/h9-10H,4-8H2,1-3H3.
What are the key properties of 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline?
1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline has a molecular weight of 207.32 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methoxy-8-methyl-3,4,7,8-tetrahydro-2H-quinoline is sourced from PubChem (CID 146658784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).