2-methyl-3,4,7,8-tetrahydroquinoline

C10H13N — CID 89138191

IUPAC2-methyl-3,4,7,8-tetrahydroquinoline
SMILESCC1=NC2=C(C=CCC2)CC1
InChIInChI=1S/C10H13N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h2,4H,3,5-7H2,1H3
InChIKeyMQMAANSXUAALEZ-UHFFFAOYSA-N
MW147.22 g/mol
LogP2.85
Rot. Bonds

About 2-methyl-3,4,7,8-tetrahydroquinoline

2-methyl-3,4,7,8-tetrahydroquinoline (PubChem CID 89138191) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is 2-methyl-3,4,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name2-methyl-3,4,7,8-tetrahydroquinoline
PubChem CID89138191
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name2-methyl-3,4,7,8-tetrahydroquinoline
SMILESCC1=NC2=C(C=CCC2)CC1
InChIInChI=1S/C10H13N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h2,4H,3,5-7H2,1H3
InChIKeyMQMAANSXUAALEZ-UHFFFAOYSA-N
XLogP2.85
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 ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3,4,7,8-tetrahydroquinoline?
The IUPAC name of 2-methyl-3,4,7,8-tetrahydroquinoline (CID 89138191) is 2-methyl-3,4,7,8-tetrahydroquinoline.
What is the SMILES notation for 2-methyl-3,4,7,8-tetrahydroquinoline?
The canonical SMILES for 2-methyl-3,4,7,8-tetrahydroquinoline is CC1=NC2=C(C=CCC2)CC1.
What is the InChIKey of 2-methyl-3,4,7,8-tetrahydroquinoline?
The InChIKey is MQMAANSXUAALEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h2,4H,3,5-7H2,1H3.
What are the key properties of 2-methyl-3,4,7,8-tetrahydroquinoline?
2-methyl-3,4,7,8-tetrahydroquinoline has a molecular weight of 147.22 g/mol, XLogP of 2.85, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3,4,7,8-tetrahydroquinoline is sourced from PubChem (CID 89138191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).