2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline

C22H19N — CID 57166533

IUPAC2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline
SMILESCc1ccc2ccccc2c1CCc1ccc2ccccc2n1
InChIInChI=1S/C22H19N/c1-16-10-11-17-6-2-4-8-21(17)20(16)15-14-19-13-12-18-7-3-5-9-22(18)23-19/h2-13H,14-15H2,1H3
InChIKeyCNYQKXUMCXIEEI-UHFFFAOYSA-N
MW297.40 g/mol
LogP5.48
Rot. Bonds3

About 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline

2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline (PubChem CID 57166533) has the molecular formula C22H19N and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline.

Molecular Properties

Compound Name2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline
PubChem CID57166533
Molecular FormulaC22H19N
Molecular Weight297.40 g/mol
Exact Mass297.15
IUPAC Name2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline
SMILESCc1ccc2ccccc2c1CCc1ccc2ccccc2n1
InChIInChI=1S/C22H19N/c1-16-10-11-17-6-2-4-8-21(17)20(16)15-14-19-13-12-18-7-3-5-9-22(18)23-19/h2-13H,14-15H2,1H3
InChIKeyCNYQKXUMCXIEEI-UHFFFAOYSA-N
XLogP5.48
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.40
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(3-methylphenyl)ethyl]quinoline
CID 71620221
2-(10-quinolin-2-yldecyl)quinoline;hydrate
CID 144702573
2-(2-methoxyethyl)quinoline
CID 129321824
2-methyl-N-(2-quinolin-2-ylethyl)propan-2-amine
CID 62549000
2-(2-quinolin-2-ylethyl)-3H-benzo[g]indole
CID 158162611
2-(2-quinolin-2-ylethyl)phenol;hydrochloride
CID 90025480
N,N-dimethyl-3-quinolin-2-ylpropanamide
CID 110464890
CID 89210421
CID 89210421
2-(methylsulfonylmethyl)quinoline
CID 14901365
O-(2-quinolin-2-ylethyl)hydroxylamine
CID 119091598
3-quinolin-2-ylpropan-1-ol;dihydrochloride
CID 175501927
N-[[3,5-bis[[bis(quinolin-2-ylmethyl)amino]methyl]-2,4,6-trimethylphenyl]methyl]-1-quinolin-2-yl-N-(quinolin-2-ylmethyl)methanamine
CID 139172571

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline?
The IUPAC name of 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline (CID 57166533) is 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline.
What is the SMILES notation for 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline?
The canonical SMILES for 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline is Cc1ccc2ccccc2c1CCc1ccc2ccccc2n1.
What is the InChIKey of 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline?
The InChIKey is CNYQKXUMCXIEEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N/c1-16-10-11-17-6-2-4-8-21(17)20(16)15-14-19-13-12-18-7-3-5-9-22(18)23-19/h2-13H,14-15H2,1H3.
What are the key properties of 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline?
2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline has a molecular weight of 297.40 g/mol, XLogP of 5.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methylnaphthalen-1-yl)ethyl]quinoline is sourced from PubChem (CID 57166533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).