(1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol

C7H9ClN2O2 — CID 168935761

IUPAC(1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol
SMILESCOc1nnc(Cl)cc1[C@@H](C)O
InChIInChI=1S/C7H9ClN2O2/c1-4(11)5-3-6(8)9-10-7(5)12-2/h3-4,11H,1-2H3/t4-/m1/s1
InChIKeyDEIFTQRQZVSVRQ-SCSAIBSYSA-N
MW188.61 g/mol
LogP1.19
Rot. Bonds2

About (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol

(1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol (PubChem CID 168935761) has the molecular formula C7H9ClN2O2 and a molecular weight of 188.61 g/mol. Its IUPAC name is (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol.

Molecular Properties

Compound Name(1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol
PubChem CID168935761
Molecular FormulaC7H9ClN2O2
Molecular Weight188.61 g/mol
Exact Mass188.04
IUPAC Name(1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol
SMILESCOc1nnc(Cl)cc1[C@@H](C)O
InChIInChI=1S/C7H9ClN2O2/c1-4(11)5-3-6(8)9-10-7(5)12-2/h3-4,11H,1-2H3/t4-/m1/s1
InChIKeyDEIFTQRQZVSVRQ-SCSAIBSYSA-N
XLogP1.19
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.61
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol?
The IUPAC name of (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol (CID 168935761) is (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol.
What is the SMILES notation for (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol?
The canonical SMILES for (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol is COc1nnc(Cl)cc1[C@@H](C)O.
What is the InChIKey of (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol?
The InChIKey is DEIFTQRQZVSVRQ-SCSAIBSYSA-N. The full InChI is InChI=1S/C7H9ClN2O2/c1-4(11)5-3-6(8)9-10-7(5)12-2/h3-4,11H,1-2H3/t4-/m1/s1.
What are the key properties of (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol?
(1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol has a molecular weight of 188.61 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(6-chloro-3-methoxypyridazin-4-yl)ethanol is sourced from PubChem (CID 168935761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).