2-methyl-6,7,8,8a-tetrahydroquinoline

C10H13N — CID 130474029

IUPAC2-methyl-6,7,8,8a-tetrahydroquinoline
SMILESCC1=NC2CCCC=C2C=C1
InChIInChI=1S/C10H13N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h4,6-7,10H,2-3,5H2,1H3
InChIKeyAUHYFCRAAUHQGW-UHFFFAOYSA-N
MW147.22 g/mol
LogP2.50
Rot. Bonds

About 2-methyl-6,7,8,8a-tetrahydroquinoline

2-methyl-6,7,8,8a-tetrahydroquinoline (PubChem CID 130474029) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is 2-methyl-6,7,8,8a-tetrahydroquinoline.

Molecular Properties

Compound Name2-methyl-6,7,8,8a-tetrahydroquinoline
PubChem CID130474029
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name2-methyl-6,7,8,8a-tetrahydroquinoline
SMILESCC1=NC2CCCC=C2C=C1
InChIInChI=1S/C10H13N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h4,6-7,10H,2-3,5H2,1H3
InChIKeyAUHYFCRAAUHQGW-UHFFFAOYSA-N
XLogP2.50
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6,7,8,8a-tetrahydroquinoline?
The IUPAC name of 2-methyl-6,7,8,8a-tetrahydroquinoline (CID 130474029) is 2-methyl-6,7,8,8a-tetrahydroquinoline.
What is the SMILES notation for 2-methyl-6,7,8,8a-tetrahydroquinoline?
The canonical SMILES for 2-methyl-6,7,8,8a-tetrahydroquinoline is CC1=NC2CCCC=C2C=C1.
What is the InChIKey of 2-methyl-6,7,8,8a-tetrahydroquinoline?
The InChIKey is AUHYFCRAAUHQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h4,6-7,10H,2-3,5H2,1H3.
What are the key properties of 2-methyl-6,7,8,8a-tetrahydroquinoline?
2-methyl-6,7,8,8a-tetrahydroquinoline has a molecular weight of 147.22 g/mol, XLogP of 2.50, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6,7,8,8a-tetrahydroquinoline is sourced from PubChem (CID 130474029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).