6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline

C17H19N — CID 62502822

IUPAC6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCc1ccc(-c2ccc3c(c2)CCCN3)c(C)c1
InChIInChI=1S/C17H19N/c1-12-5-7-16(13(2)10-12)14-6-8-17-15(11-14)4-3-9-18-17/h5-8,10-11,18H,3-4,9H2,1-2H3
InChIKeyPIDSKUWACITDNJ-UHFFFAOYSA-N
MW237.35 g/mol
LogP4.33
Rot. Bonds1

About 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline

6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 62502822) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline
PubChem CID62502822
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCc1ccc(-c2ccc3c(c2)CCCN3)c(C)c1
InChIInChI=1S/C17H19N/c1-12-5-7-16(13(2)10-12)14-6-8-17-15(11-14)4-3-9-18-17/h5-8,10-11,18H,3-4,9H2,1-2H3
InChIKeyPIDSKUWACITDNJ-UHFFFAOYSA-N
XLogP4.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-(2-fluoro-5-methylphenyl)-1,2,3,4-tetrahydroquinoline
CID 62500792
ethane;6-methyl-1,2,3,4-tetrahydroquinoline
CID 144598135
6-methyl-1,2,3,4-tetrahydroquinoline;molecular iodine
CID 159662716
6-(2,3,4,5,6-pentamethylphenyl)-1,2,3,4-tetrahydroquinoline
CID 63424137
6-[2-(4-methylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63968254
6-methyl-2-(1,2,3,4-tetrahydroquinolin-6-yl)-1,3-benzoxazole
CID 43436668
6-(4-methoxy-3-methylphenyl)-1,2,3,4-tetrahydroquinoline
CID 62500963
ethane;7-methyl-1,2,3,4-tetrahydroquinoline
CID 142224426
N,N-dimethyl-4-(1,2,3,4-tetrahydroquinolin-6-yl)aniline
CID 39232365
6-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydroquinoline
CID 55197505
6-[2-(2,4,6-trimethylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63968458
6-(5-fluoro-2-methoxyphenyl)-1,2,3,4-tetrahydroquinoline
CID 55079489

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline (CID 62502822) is 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline is Cc1ccc(-c2ccc3c(c2)CCCN3)c(C)c1.
What is the InChIKey of 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is PIDSKUWACITDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c1-12-5-7-16(13(2)10-12)14-6-8-17-15(11-14)4-3-9-18-17/h5-8,10-11,18H,3-4,9H2,1-2H3.
What are the key properties of 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline?
6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 237.35 g/mol, XLogP of 4.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 62502822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).