2-methoxy-5,6,7,8-tetrahydroquinoline

C10H13NO — CID 18180283

IUPAC2-methoxy-5,6,7,8-tetrahydroquinoline
SMILESCOc1ccc2c(n1)CCCC2
InChIInChI=1S/C10H13NO/c1-12-10-7-6-8-4-2-3-5-9(8)11-10/h6-7H,2-5H2,1H3
InChIKeyJHMZTXNXIOTPLE-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.97
Rot. Bonds1

About 2-methoxy-5,6,7,8-tetrahydroquinoline

2-methoxy-5,6,7,8-tetrahydroquinoline (PubChem CID 18180283) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 2-methoxy-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name2-methoxy-5,6,7,8-tetrahydroquinoline
PubChem CID18180283
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name2-methoxy-5,6,7,8-tetrahydroquinoline
SMILESCOc1ccc2c(n1)CCCC2
InChIInChI=1S/C10H13NO/c1-12-10-7-6-8-4-2-3-5-9(8)11-10/h6-7H,2-5H2,1H3
InChIKeyJHMZTXNXIOTPLE-UHFFFAOYSA-N
XLogP1.97
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 2-methoxy-5,6,7,8-tetrahydroquinoline (CID 18180283) is 2-methoxy-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 2-methoxy-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 2-methoxy-5,6,7,8-tetrahydroquinoline is COc1ccc2c(n1)CCCC2.
What is the InChIKey of 2-methoxy-5,6,7,8-tetrahydroquinoline?
The InChIKey is JHMZTXNXIOTPLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-12-10-7-6-8-4-2-3-5-9(8)11-10/h6-7H,2-5H2,1H3.
What are the key properties of 2-methoxy-5,6,7,8-tetrahydroquinoline?
2-methoxy-5,6,7,8-tetrahydroquinoline has a molecular weight of 163.22 g/mol, XLogP of 1.97, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 18180283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).