5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline

C12H15NO — CID 4594013

IUPAC5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline
SMILESCN1CC2CCOC2c2ccccc21
InChIInChI=1S/C12H15NO/c1-13-8-9-6-7-14-12(9)10-4-2-3-5-11(10)13/h2-5,9,12H,6-8H2,1H3
InChIKeyLSYUAYHPEJDMHP-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.21
Rot. Bonds

About 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline

5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline (PubChem CID 4594013) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline.

Molecular Properties

Compound Name5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline
PubChem CID4594013
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline
SMILESCN1CC2CCOC2c2ccccc21
InChIInChI=1S/C12H15NO/c1-13-8-9-6-7-14-12(9)10-4-2-3-5-11(10)13/h2-5,9,12H,6-8H2,1H3
InChIKeyLSYUAYHPEJDMHP-UHFFFAOYSA-N
XLogP2.21
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline?
The IUPAC name of 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline (CID 4594013) is 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline.
What is the SMILES notation for 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline?
The canonical SMILES for 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline is CN1CC2CCOC2c2ccccc21.
What is the InChIKey of 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline?
The InChIKey is LSYUAYHPEJDMHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-13-8-9-6-7-14-12(9)10-4-2-3-5-11(10)13/h2-5,9,12H,6-8H2,1H3.
What are the key properties of 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline?
5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline has a molecular weight of 189.26 g/mol, XLogP of 2.21, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]quinoline is sourced from PubChem (CID 4594013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).