2-[2-(3-methylphenyl)ethyl]quinoline

C18H17N — CID 71620221

IUPAC2-[2-(3-methylphenyl)ethyl]quinoline
SMILESCc1cccc(CCc2ccc3ccccc3n2)c1
InChIInChI=1S/C18H17N/c1-14-5-4-6-15(13-14)9-11-17-12-10-16-7-2-3-8-18(16)19-17/h2-8,10,12-13H,9,11H2,1H3
InChIKeyFIRZTCRXPGUJGA-UHFFFAOYSA-N
MW247.34 g/mol
LogP4.33
Rot. Bonds3

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

2-[2-(3-methylphenyl)ethyl]quinoline (PubChem CID 71620221) has the molecular formula C18H17N and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-[2-(3-methylphenyl)ethyl]quinoline.

Molecular Properties

Compound Name2-[2-(3-methylphenyl)ethyl]quinoline
PubChem CID71620221
Molecular FormulaC18H17N
Molecular Weight247.34 g/mol
Exact Mass247.14
IUPAC Name2-[2-(3-methylphenyl)ethyl]quinoline
SMILESCc1cccc(CCc2ccc3ccccc3n2)c1
InChIInChI=1S/C18H17N/c1-14-5-4-6-15(13-14)9-11-17-12-10-16-7-2-3-8-18(16)19-17/h2-8,10,12-13H,9,11H2,1H3
InChIKeyFIRZTCRXPGUJGA-UHFFFAOYSA-N
XLogP4.33
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(3-methylphenyl)methyl]quinoline
CID 91665483
7-methyl-2-(quinolin-2-ylmethyl)quinoline
CID 146200056
2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline
CID 57166533
2-(10-quinolin-2-yldecyl)quinoline;hydrate
CID 144702573
2-(2-methoxyethyl)quinoline
CID 129321824
(3-methylphenyl)methyl quinoline-2-carboxylate
CID 7813134
6-bromo-2-(2-phenylethyl)quinoline
CID 59459867
2-[2-(4-methylphenyl)-3-quinolin-2-ylpropyl]quinoline
CID 132563536
quinolin-2-ylmethyl N-[(E)-1-(3-methylphenyl)ethylideneamino]carbamodithioate
CID 139072296
1-methyl-2-[2-(3-methylphenyl)ethyl]benzene
CID 13419836
2-(2-quinolin-2-ylethyl)phenol;hydrochloride
CID 90025480
N,N-dimethyl-3-quinolin-2-ylpropanamide
CID 110464890

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methylphenyl)ethyl]quinoline?
The IUPAC name of 2-[2-(3-methylphenyl)ethyl]quinoline (CID 71620221) is 2-[2-(3-methylphenyl)ethyl]quinoline.
What is the SMILES notation for 2-[2-(3-methylphenyl)ethyl]quinoline?
The canonical SMILES for 2-[2-(3-methylphenyl)ethyl]quinoline is Cc1cccc(CCc2ccc3ccccc3n2)c1.
What is the InChIKey of 2-[2-(3-methylphenyl)ethyl]quinoline?
The InChIKey is FIRZTCRXPGUJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N/c1-14-5-4-6-15(13-14)9-11-17-12-10-16-7-2-3-8-18(16)19-17/h2-8,10,12-13H,9,11H2,1H3.
What are the key properties of 2-[2-(3-methylphenyl)ethyl]quinoline?
2-[2-(3-methylphenyl)ethyl]quinoline has a molecular weight of 247.34 g/mol, XLogP of 4.33, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methylphenyl)ethyl]quinoline is sourced from PubChem (CID 71620221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).