6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline

C14H10ClN3O — CID 171090319

IUPAC6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline
SMILESClc1cc(OCc2ccc3ncccc3c2)cnn1
InChIInChI=1S/C14H10ClN3O/c15-14-7-12(8-17-18-14)19-9-10-3-4-13-11(6-10)2-1-5-16-13/h1-8H,9H2
InChIKeyRSULYSBUFXTCJA-UHFFFAOYSA-N
MW271.71 g/mol
LogP3.26
Rot. Bonds3

About 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline

6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline (PubChem CID 171090319) has the molecular formula C14H10ClN3O and a molecular weight of 271.71 g/mol. Its IUPAC name is 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline.

Molecular Properties

Compound Name6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline
PubChem CID171090319
Molecular FormulaC14H10ClN3O
Molecular Weight271.71 g/mol
Exact Mass271.05
IUPAC Name6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline
SMILESClc1cc(OCc2ccc3ncccc3c2)cnn1
InChIInChI=1S/C14H10ClN3O/c15-14-7-12(8-17-18-14)19-9-10-3-4-13-11(6-10)2-1-5-16-13/h1-8H,9H2
InChIKeyRSULYSBUFXTCJA-UHFFFAOYSA-N
XLogP3.26
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.71
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(6-chloropyridazin-4-yl)oxymethyl]-3-cyclopropylquinoline
CID 171089580
3-chloro-2-(quinolin-6-ylmethoxy)aniline
CID 107715957
6-[(1-ethylpyrazol-4-yl)oxymethyl]quinoline
CID 116804581
2,5-dimethyl-4-(quinolin-6-ylmethoxy)aniline
CID 63180873
(1S)-1-[4-(quinolin-6-ylmethoxy)phenyl]ethanol
CID 78933378
6-[(4-fluorophenyl)methoxy]quinoline
CID 60595158
[4-(quinolin-6-yloxymethyl)phenyl]methanol
CID 110005974
6-[(1-propylpyrazol-4-yl)oxymethyl]quinoline
CID 116804981
2-(quinolin-6-ylmethoxy)benzenecarbothioamide
CID 28776448
6-[[2-(chloromethyl)-6-methyl-3-pyridinyl]oxymethyl]quinoline
CID 79163844
6-[[4-(chloromethyl)-2-fluorophenoxy]methyl]quinoline
CID 107691122
2-methyl-6-(quinolin-6-ylmethoxy)aniline
CID 43438024

Frequently Asked Questions

What is the IUPAC name of 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline?
The IUPAC name of 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline (CID 171090319) is 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline.
What is the SMILES notation for 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline?
The canonical SMILES for 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline is Clc1cc(OCc2ccc3ncccc3c2)cnn1.
What is the InChIKey of 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline?
The InChIKey is RSULYSBUFXTCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O/c15-14-7-12(8-17-18-14)19-9-10-3-4-13-11(6-10)2-1-5-16-13/h1-8H,9H2.
What are the key properties of 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline?
6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline has a molecular weight of 271.71 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(6-chloropyridazin-4-yl)oxymethyl]quinoline is sourced from PubChem (CID 171090319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).