4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline

C17H19N — CID 79234771

IUPAC4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline
SMILESCC1CC(Cc2ccccc2)c2ccccc2N1
InChIInChI=1S/C17H19N/c1-13-11-15(12-14-7-3-2-4-8-14)16-9-5-6-10-17(16)18-13/h2-10,13,15,18H,11-12H2,1H3
InChIKeyCJWVNWRIGKFCGM-UHFFFAOYSA-N
MW237.35 g/mol
LogP4.22
Rot. Bonds2

About 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline

4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 79234771) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID79234771
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline
SMILESCC1CC(Cc2ccccc2)c2ccccc2N1
InChIInChI=1S/C17H19N/c1-13-11-15(12-14-7-3-2-4-8-14)16-9-5-6-10-17(16)18-13/h2-10,13,15,18H,11-12H2,1H3
InChIKeyCJWVNWRIGKFCGM-UHFFFAOYSA-N
XLogP4.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline (CID 79234771) is 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline is CC1CC(Cc2ccccc2)c2ccccc2N1.
What is the InChIKey of 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is CJWVNWRIGKFCGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c1-13-11-15(12-14-7-3-2-4-8-14)16-9-5-6-10-17(16)18-13/h2-10,13,15,18H,11-12H2,1H3.
What are the key properties of 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline?
4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 237.35 g/mol, XLogP of 4.22, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 79234771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).