6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline

C15H14N4 — CID 114719931

IUPAC6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline
SMILESc1cnc2ccc(-n3cncc3C3CNC3)cc2c1
InChIInChI=1S/C15H14N4/c1-2-11-6-13(3-4-14(11)18-5-1)19-10-17-9-15(19)12-7-16-8-12/h1-6,9-10,12,16H,7-8H2
InChIKeyQHAKCLBQMOVVFY-UHFFFAOYSA-N
MW250.31 g/mol
LogP2.11
Rot. Bonds2

About 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline

6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline (PubChem CID 114719931) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline.

Molecular Properties

Compound Name6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline
PubChem CID114719931
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC Name6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline
SMILESc1cnc2ccc(-n3cncc3C3CNC3)cc2c1
InChIInChI=1S/C15H14N4/c1-2-11-6-13(3-4-14(11)18-5-1)19-10-17-9-15(19)12-7-16-8-12/h1-6,9-10,12,16H,7-8H2
InChIKeyQHAKCLBQMOVVFY-UHFFFAOYSA-N
XLogP2.11
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(azetidin-3-yl)-1-(3-chlorophenyl)imidazole
CID 114716199
(1R)-1-(3-quinolin-6-ylimidazol-4-yl)propan-1-amine
CID 104942904
3-[5-(azetidin-3-yl)imidazol-1-yl]-5-methylpyridine
CID 107587235
1-(3-iodophenyl)-5-pyrrolidin-3-ylimidazole
CID 114716120
1-quinolin-6-yl-2-sulfanylidenepyrimidin-4-one
CID 62635297
4-[3-(1-benzothiophen-5-yl)imidazol-4-yl]piperidine
CID 114706284
6-(1,4-diazepan-1-yl)quinoline
CID 62635992
5-(azetidin-3-yl)-1-(2-chloro-4-fluorophenyl)imidazole
CID 114716072
N-methyl-1-quinolin-6-ylimidazol-2-amine
CID 106570148
6-(azetidin-3-yloxy)quinoline;hydrochloride
CID 86262635
4-quinolin-6-yl-4-azatricyclo[5.2.1.02,6]deca-2,5-diene-3,5-diol
CID 91307807
6-(azetidin-3-ylmethoxy)quinoline
CID 86262198

Frequently Asked Questions

What is the IUPAC name of 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline?
The IUPAC name of 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline (CID 114719931) is 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline.
What is the SMILES notation for 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline?
The canonical SMILES for 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline is c1cnc2ccc(-n3cncc3C3CNC3)cc2c1.
What is the InChIKey of 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline?
The InChIKey is QHAKCLBQMOVVFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-2-11-6-13(3-4-14(11)18-5-1)19-10-17-9-15(19)12-7-16-8-12/h1-6,9-10,12,16H,7-8H2.
What are the key properties of 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline?
6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline has a molecular weight of 250.31 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(azetidin-3-yl)imidazol-1-yl]quinoline is sourced from PubChem (CID 114719931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).