5-(2-imidazol-1-ylethyl)quinoline

C14H13N3 — CID 10751574

IUPAC5-(2-imidazol-1-ylethyl)quinoline
SMILESc1cc(CCn2ccnc2)c2cccnc2c1
InChIInChI=1S/C14H13N3/c1-3-12(6-9-17-10-8-15-11-17)13-4-2-7-16-14(13)5-1/h1-5,7-8,10-11H,6,9H2
InChIKeyAVFNKJKCERQPJI-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.67
Rot. Bonds3

About 5-(2-imidazol-1-ylethyl)quinoline

5-(2-imidazol-1-ylethyl)quinoline (PubChem CID 10751574) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is 5-(2-imidazol-1-ylethyl)quinoline.

Molecular Properties

Compound Name5-(2-imidazol-1-ylethyl)quinoline
PubChem CID10751574
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Name5-(2-imidazol-1-ylethyl)quinoline
SMILESc1cc(CCn2ccnc2)c2cccnc2c1
InChIInChI=1S/C14H13N3/c1-3-12(6-9-17-10-8-15-11-17)13-4-2-7-16-14(13)5-1/h1-5,7-8,10-11H,6,9H2
InChIKeyAVFNKJKCERQPJI-UHFFFAOYSA-N
XLogP2.67
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 57469
2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
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2-Amino-3-methylimidazo(4,5-f)quinoline
CID 53462
2-Amino-3,4-dimethylimidazo(4,5-f)quinoline
CID 62274
2-Amino-3,4,8-trimethylimidazo(4,5-f)quinoxaline
CID 104739
CR-4056
CID 24898732
3-(Imidazo(1,2-a)pyrimidin-2-yl)aniline
CID 1477845
Florquinitau
CID 118577045
7-(1-Ethyl-propyl)-7H-pyrrolo-[3,2-F]quinazoline-1,3-diamine
CID 1881
1-benzyl-5-phenyl-1H-imidazole
CID 10444038
N-Hydroxy-3-methyl-3H-imidazo(4,5-f)quinolin-2-amine
CID 105079
6-Amino-4-[(3-methylphenyl)amino]pyrido[3,4-d]pyrimidine
CID 5328375

Frequently Asked Questions

What is the IUPAC name of 5-(2-imidazol-1-ylethyl)quinoline?
The IUPAC name of 5-(2-imidazol-1-ylethyl)quinoline (CID 10751574) is 5-(2-imidazol-1-ylethyl)quinoline.
What is the SMILES notation for 5-(2-imidazol-1-ylethyl)quinoline?
The canonical SMILES for 5-(2-imidazol-1-ylethyl)quinoline is c1cc(CCn2ccnc2)c2cccnc2c1.
What is the InChIKey of 5-(2-imidazol-1-ylethyl)quinoline?
The InChIKey is AVFNKJKCERQPJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3/c1-3-12(6-9-17-10-8-15-11-17)13-4-2-7-16-14(13)5-1/h1-5,7-8,10-11H,6,9H2.
What are the key properties of 5-(2-imidazol-1-ylethyl)quinoline?
5-(2-imidazol-1-ylethyl)quinoline has a molecular weight of 223.28 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-imidazol-1-ylethyl)quinoline is sourced from PubChem (CID 10751574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).