[6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol

C14H17N3O2 — CID 61417756

IUPAC[6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol
SMILESCOc1cccc(CN(C)c2ccc(CO)nn2)c1
InChIInChI=1S/C14H17N3O2/c1-17(14-7-6-12(10-18)15-16-14)9-11-4-3-5-13(8-11)19-2/h3-8,18H,9-10H2,1-2H3
InChIKeyWMZOSEOBSZDRFA-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.61
Rot. Bonds5

About [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol

[6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol (PubChem CID 61417756) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol.

Molecular Properties

Compound Name[6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol
PubChem CID61417756
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name[6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol
SMILESCOc1cccc(CN(C)c2ccc(CO)nn2)c1
InChIInChI=1S/C14H17N3O2/c1-17(14-7-6-12(10-18)15-16-14)9-11-4-3-5-13(8-11)19-2/h3-8,18H,9-10H2,1-2H3
InChIKeyWMZOSEOBSZDRFA-UHFFFAOYSA-N
XLogP1.61
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-bromo-N-[(3-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 63962800
4-(chloromethyl)-N-[(3-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 61418126
2-[(3-methoxyphenyl)methyl-methylamino]pyridine-4-carboxylic acid
CID 60709004
N-[(3-methoxyphenyl)methyl]-N-methylaniline
CID 66916764
(3-methoxyphenyl)(113C)methanol
CID 11593446
4-N-[(3-methoxyphenyl)methyl]-2-N,4-N-dimethylpyrimidine-2,4-diamine
CID 80794833
2-chloro-6-[(3-methoxyphenyl)methyl-methylamino]pyridine-4-carboxylic acid
CID 61417811
4-N-[(3-methoxyphenyl)methyl]-4-N,2-dimethylpyrimidine-4,6-diamine
CID 80794623
[2-[(3-methoxyphenyl)methyl-methylamino]-4,6-dimethyl-3-pyridinyl]methanol
CID 61417707
methyl 6-[(3-methoxyphenyl)methyl-methylamino]pyrazine-2-carboxylate
CID 66455869
N-[(3-methoxyphenyl)methyl]-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 171690653
5-fluoro-N-[(3-methoxyphenyl)methyl]-N-methylpyrimidin-2-amine
CID 171328588

Frequently Asked Questions

What is the IUPAC name of [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol?
The IUPAC name of [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol (CID 61417756) is [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol.
What is the SMILES notation for [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol?
The canonical SMILES for [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol is COc1cccc(CN(C)c2ccc(CO)nn2)c1.
What is the InChIKey of [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol?
The InChIKey is WMZOSEOBSZDRFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-17(14-7-6-12(10-18)15-16-14)9-11-4-3-5-13(8-11)19-2/h3-8,18H,9-10H2,1-2H3.
What are the key properties of [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol?
[6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol has a molecular weight of 259.31 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(3-methoxyphenyl)methyl-methylamino]pyridazin-3-yl]methanol is sourced from PubChem (CID 61417756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).