2-[(3-methylphenyl)methyl]quinoline

C17H15N — CID 91665483

IUPAC2-[(3-methylphenyl)methyl]quinoline
SMILESCc1cccc(Cc2ccc3ccccc3n2)c1
InChIInChI=1S/C17H15N/c1-13-5-4-6-14(11-13)12-16-10-9-15-7-2-3-8-17(15)18-16/h2-11H,12H2,1H3
InChIKeyUYHWCFSLGPOTRL-UHFFFAOYSA-N
MW233.31 g/mol
LogP4.13
Rot. Bonds2

About 2-[(3-methylphenyl)methyl]quinoline

2-[(3-methylphenyl)methyl]quinoline (PubChem CID 91665483) has the molecular formula C17H15N and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-[(3-methylphenyl)methyl]quinoline.

Molecular Properties

Compound Name2-[(3-methylphenyl)methyl]quinoline
PubChem CID91665483
Molecular FormulaC17H15N
Molecular Weight233.31 g/mol
Exact Mass233.12
IUPAC Name2-[(3-methylphenyl)methyl]quinoline
SMILESCc1cccc(Cc2ccc3ccccc3n2)c1
InChIInChI=1S/C17H15N/c1-13-5-4-6-14(11-13)12-16-10-9-15-7-2-3-8-17(15)18-16/h2-11H,12H2,1H3
InChIKeyUYHWCFSLGPOTRL-UHFFFAOYSA-N
XLogP4.13
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(3-methylphenyl)ethyl]quinoline
CID 71620221
7-methyl-2-(quinolin-2-ylmethyl)quinoline
CID 146200056
3-methyl-5-(quinolin-2-ylmethyl)-1H-pyridin-2-one
CID 83130354
5-methyl-2-(quinolin-2-ylmethyl)benzoic acid
CID 81111502
(3-methylphenyl)methyl quinoline-2-carboxylate
CID 7813134
2-[(6-chloro-2-propan-2-ylpyrimidin-4-yl)methyl]quinoline
CID 80947388
2,3,5-trimethyl-6-(quinolin-2-ylmethyl)benzene-1,4-diol
CID 2104010
CID 89210421
CID 89210421
7-methyl-2-(naphthalen-2-ylmethyl)quinoxaline
CID 146214329
5-bromo-2-[(3-methylphenyl)methyl]imidazo[1,2-a]pyridine
CID 117132587
quinolin-2-ylmethanamine;dihydrochloride
CID 18507294
2-(iodomethyl)quinoline
CID 19432604

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methylphenyl)methyl]quinoline?
The IUPAC name of 2-[(3-methylphenyl)methyl]quinoline (CID 91665483) is 2-[(3-methylphenyl)methyl]quinoline.
What is the SMILES notation for 2-[(3-methylphenyl)methyl]quinoline?
The canonical SMILES for 2-[(3-methylphenyl)methyl]quinoline is Cc1cccc(Cc2ccc3ccccc3n2)c1.
What is the InChIKey of 2-[(3-methylphenyl)methyl]quinoline?
The InChIKey is UYHWCFSLGPOTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N/c1-13-5-4-6-14(11-13)12-16-10-9-15-7-2-3-8-17(15)18-16/h2-11H,12H2,1H3.
What are the key properties of 2-[(3-methylphenyl)methyl]quinoline?
2-[(3-methylphenyl)methyl]quinoline has a molecular weight of 233.31 g/mol, XLogP of 4.13, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methylphenyl)methyl]quinoline is sourced from PubChem (CID 91665483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).