2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline

C19H23N — CID 145346647

IUPAC2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline
SMILESCC(C)c1ccccc1-c1ccc2c(c1)CCN(C)C2
InChIInChI=1S/C19H23N/c1-14(2)18-6-4-5-7-19(18)16-8-9-17-13-20(3)11-10-15(17)12-16/h4-9,12,14H,10-11,13H2,1-3H3
InChIKeyJNMLFHRRJYHETE-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.46
Rot. Bonds2

About 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline

2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline (PubChem CID 145346647) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline.

Molecular Properties

Compound Name2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline
PubChem CID145346647
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline
SMILESCC(C)c1ccccc1-c1ccc2c(c1)CCN(C)C2
InChIInChI=1S/C19H23N/c1-14(2)18-6-4-5-7-19(18)16-8-9-17-13-20(3)11-10-15(17)12-16/h4-9,12,14H,10-11,13H2,1-3H3
InChIKeyJNMLFHRRJYHETE-UHFFFAOYSA-N
XLogP4.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

7-(4-chloro-2-propan-2-ylphenyl)-2-methyl-3,4-dihydro-1H-isoquinoline
CID 172543647
methane;2-methyl-3,4-dihydro-1H-isoquinoline
CID 161283116
methanol;2-methyl-3,4-dihydro-1H-isoquinoline
CID 142001874
6-bromo-2-methyl-3,4-dihydro-1H-isoquinoline
CID 53408381
2-methyl-6-phenoxy-3,4-dihydro-1H-isoquinoline
CID 166626286
3-(2,4-dimethyl-5-propan-2-ylphenyl)-4-(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)-1,2-oxazole-5-carboxamide
CID 134166556
6-methyl-5,7,8,14-tetrahydrobenzo[e][2]benzazecin-13-one
CID 168786379
7-(3-chlorophenyl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepine
CID 67380705
N-methyl-4-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)aniline
CID 143613959
(2-methyl-3,4-dihydro-1H-isoquinolin-6-yl)methylphosphane
CID 155201597
2-methyl-4-(2-propan-2-ylphenyl)phenol
CID 22438316
6-ethoxy-2-methyl-3,4-dihydro-1H-isoquinoline;hydrochloride
CID 3029133

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline?
The IUPAC name of 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline (CID 145346647) is 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline.
What is the SMILES notation for 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline?
The canonical SMILES for 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline is CC(C)c1ccccc1-c1ccc2c(c1)CCN(C)C2.
What is the InChIKey of 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline?
The InChIKey is JNMLFHRRJYHETE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-14(2)18-6-4-5-7-19(18)16-8-9-17-13-20(3)11-10-15(17)12-16/h4-9,12,14H,10-11,13H2,1-3H3.
What are the key properties of 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline?
2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline has a molecular weight of 265.40 g/mol, XLogP of 4.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-propan-2-ylphenyl)-3,4-dihydro-1H-isoquinoline is sourced from PubChem (CID 145346647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).