8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline

C13H13N3 — CID 142688979

IUPAC8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline
SMILESC1=C(Cc2cccc3cccnc23)NCN1
InChIInChI=1S/C13H13N3/c1-3-10-5-2-6-15-13(10)11(4-1)7-12-8-14-9-16-12/h1-6,8,14,16H,7,9H2
InChIKeyQCGQLUCAENYYRX-UHFFFAOYSA-N
MW211.27 g/mol
LogP1.77
Rot. Bonds2

About 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline

8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline (PubChem CID 142688979) has the molecular formula C13H13N3 and a molecular weight of 211.27 g/mol. Its IUPAC name is 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline.

Molecular Properties

Compound Name8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline
PubChem CID142688979
Molecular FormulaC13H13N3
Molecular Weight211.27 g/mol
Exact Mass211.11
IUPAC Name8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline
SMILESC1=C(Cc2cccc3cccnc23)NCN1
InChIInChI=1S/C13H13N3/c1-3-10-5-2-6-15-13(10)11(4-1)7-12-8-14-9-16-12/h1-6,8,14,16H,7,9H2
InChIKeyQCGQLUCAENYYRX-UHFFFAOYSA-N
XLogP1.77
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.27
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

aluminum quinolin-8-ylmethanol
CID 23124809
8-(cyclopentyloxymethyl)quinoline
CID 126674909
quinolin-8-ylmethanamine;hydrochloride
CID 50988699
8-[2-(4-fluorophenyl)ethyl]quinoline
CID 143373037
N-methyl-2-quinolin-8-ylethanamine
CID 62549686
1-(quinolin-8-ylmethyl)cyclohexan-1-amine
CID 114277682
4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine
CID 81426138
bis(N-methyl-1-quinolin-8-ylmethanamine);oxalic acid
CID 121229149
N-(quinolin-8-ylmethyl)aniline
CID 28610045
8-(piperidin-2-ylmethoxymethyl)quinoline
CID 62341251
1-(quinolin-8-ylmethyl)cycloheptane-1-carboxylic acid
CID 79423211
N-methyl-1-phenyl-3-quinolin-8-ylpropan-1-amine
CID 81230696

Frequently Asked Questions

What is the IUPAC name of 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline?
The IUPAC name of 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline (CID 142688979) is 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline.
What is the SMILES notation for 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline?
The canonical SMILES for 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline is C1=C(Cc2cccc3cccnc23)NCN1.
What is the InChIKey of 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline?
The InChIKey is QCGQLUCAENYYRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3/c1-3-10-5-2-6-15-13(10)11(4-1)7-12-8-14-9-16-12/h1-6,8,14,16H,7,9H2.
What are the key properties of 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline?
8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline has a molecular weight of 211.27 g/mol, XLogP of 1.77, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,3-dihydro-1H-imidazol-4-ylmethyl)quinoline is sourced from PubChem (CID 142688979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).