(6-methoxypyridazin-3-yl)-phenylmethanol

C12H12N2O2 — CID 10036246

IUPAC(6-methoxypyridazin-3-yl)-phenylmethanol
SMILESCOc1ccc(C(O)c2ccccc2)nn1
InChIInChI=1S/C12H12N2O2/c1-16-11-8-7-10(13-14-11)12(15)9-5-3-2-4-6-9/h2-8,12,15H,1H3
InChIKeyAJJVTSDOXCIEPN-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.57
Rot. Bonds3

About (6-methoxypyridazin-3-yl)-phenylmethanol

(6-methoxypyridazin-3-yl)-phenylmethanol (PubChem CID 10036246) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is (6-methoxypyridazin-3-yl)-phenylmethanol.

Molecular Properties

Compound Name(6-methoxypyridazin-3-yl)-phenylmethanol
PubChem CID10036246
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name(6-methoxypyridazin-3-yl)-phenylmethanol
SMILESCOc1ccc(C(O)c2ccccc2)nn1
InChIInChI=1S/C12H12N2O2/c1-16-11-8-7-10(13-14-11)12(15)9-5-3-2-4-6-9/h2-8,12,15H,1H3
InChIKeyAJJVTSDOXCIEPN-UHFFFAOYSA-N
XLogP1.57
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-methoxypyridazin-3-yl)-phenylmethanol?
The IUPAC name of (6-methoxypyridazin-3-yl)-phenylmethanol (CID 10036246) is (6-methoxypyridazin-3-yl)-phenylmethanol.
What is the SMILES notation for (6-methoxypyridazin-3-yl)-phenylmethanol?
The canonical SMILES for (6-methoxypyridazin-3-yl)-phenylmethanol is COc1ccc(C(O)c2ccccc2)nn1.
What is the InChIKey of (6-methoxypyridazin-3-yl)-phenylmethanol?
The InChIKey is AJJVTSDOXCIEPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-16-11-8-7-10(13-14-11)12(15)9-5-3-2-4-6-9/h2-8,12,15H,1H3.
What are the key properties of (6-methoxypyridazin-3-yl)-phenylmethanol?
(6-methoxypyridazin-3-yl)-phenylmethanol has a molecular weight of 216.24 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxypyridazin-3-yl)-phenylmethanol is sourced from PubChem (CID 10036246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).