N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine

C15H19N3O — CID 106549558

IUPACN-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine
SMILESCCOCc1ccccc1CNc1cc(C)cnn1
InChIInChI=1S/C15H19N3O/c1-3-19-11-14-7-5-4-6-13(14)10-16-15-8-12(2)9-17-18-15/h4-9H,3,10-11H2,1-2H3,(H,16,18)
InChIKeyPHRWTWGRECFXLN-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.93
Rot. Bonds6

About N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine

N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine (PubChem CID 106549558) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine.

Molecular Properties

Compound NameN-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine
PubChem CID106549558
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine
SMILESCCOCc1ccccc1CNc1cc(C)cnn1
InChIInChI=1S/C15H19N3O/c1-3-19-11-14-7-5-4-6-13(14)10-16-15-8-12(2)9-17-18-15/h4-9H,3,10-11H2,1-2H3,(H,16,18)
InChIKeyPHRWTWGRECFXLN-UHFFFAOYSA-N
XLogP2.93
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-bromophenyl)methyl]-5-methylpyridazin-3-amine
CID 106549621
3-bromo-N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridin-2-amine
CID 105366749
2-N-[[2-(ethoxymethyl)phenyl]methyl]pyrazine-2,6-diamine
CID 78988831
N-[[2-(ethoxymethyl)phenyl]methyl]-5-methyl-1,3,4-thiadiazol-2-amine
CID 64915379
5-methyl-N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine
CID 106549855
5-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyridazin-3-amine
CID 106549703
[4-[[(5-methylpyridazin-3-yl)amino]methyl]phenyl]methanol
CID 107232489
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-5-methylpyridazin-3-amine
CID 106549913
N-(1-ethoxypropan-2-yl)-5-methylpyridazin-3-amine
CID 106549675
N-[[2-(methoxymethyl)phenyl]methyl]pyridazin-3-amine
CID 62482630
4-[[2-(ethoxymethyl)phenyl]methylamino]-2-methylbenzonitrile
CID 81269742
[2-(ethoxymethyl)phenyl]methylcyanamide
CID 62481050

Frequently Asked Questions

What is the IUPAC name of N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine?
The IUPAC name of N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine (CID 106549558) is N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine.
What is the SMILES notation for N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine?
The canonical SMILES for N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine is CCOCc1ccccc1CNc1cc(C)cnn1.
What is the InChIKey of N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine?
The InChIKey is PHRWTWGRECFXLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-3-19-11-14-7-5-4-6-13(14)10-16-15-8-12(2)9-17-18-15/h4-9H,3,10-11H2,1-2H3,(H,16,18).
What are the key properties of N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine?
N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine has a molecular weight of 257.34 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(ethoxymethyl)phenyl]methyl]-5-methylpyridazin-3-amine is sourced from PubChem (CID 106549558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).