6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline

C16H17N — CID 135053975

IUPAC6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline
SMILESCc1ccc2c(c1)CCC(c1ccccc1)N2
InChIInChI=1S/C16H17N/c1-12-7-9-16-14(11-12)8-10-15(17-16)13-5-3-2-4-6-13/h2-7,9,11,15,17H,8,10H2,1H3
InChIKeyBYWUQSSQEANWKP-UHFFFAOYSA-N
MW223.32 g/mol
LogP4.09
Rot. Bonds1

About 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline

6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline (PubChem CID 135053975) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline
PubChem CID135053975
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline
SMILESCc1ccc2c(c1)CCC(c1ccccc1)N2
InChIInChI=1S/C16H17N/c1-12-7-9-16-14(11-12)8-10-15(17-16)13-5-3-2-4-6-13/h2-7,9,11,15,17H,8,10H2,1H3
InChIKeyBYWUQSSQEANWKP-UHFFFAOYSA-N
XLogP4.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline (CID 135053975) is 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline is Cc1ccc2c(c1)CCC(c1ccccc1)N2.
What is the InChIKey of 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is BYWUQSSQEANWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N/c1-12-7-9-16-14(11-12)8-10-15(17-16)13-5-3-2-4-6-13/h2-7,9,11,15,17H,8,10H2,1H3.
What are the key properties of 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline?
6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 223.32 g/mol, XLogP of 4.09, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-phenyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 135053975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).