N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine

C15H17N3O2 — CID 62323240

IUPACN-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
SMILESCOc1ccc(Oc2ccc(CNC3CC3)nn2)cc1
InChIInChI=1S/C15H17N3O2/c1-19-13-5-7-14(8-6-13)20-15-9-4-12(17-18-15)10-16-11-2-3-11/h4-9,11,16H,2-3,10H2,1H3
InChIKeyWJENURYUCMPNJZ-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.53
Rot. Bonds6

About N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine

N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine (PubChem CID 62323240) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
PubChem CID62323240
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
SMILESCOc1ccc(Oc2ccc(CNC3CC3)nn2)cc1
InChIInChI=1S/C15H17N3O2/c1-19-13-5-7-14(8-6-13)20-15-9-4-12(17-18-15)10-16-11-2-3-11/h4-9,11,16H,2-3,10H2,1H3
InChIKeyWJENURYUCMPNJZ-UHFFFAOYSA-N
XLogP2.53
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[6-(3-methylphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 62297853
N-[[6-(4-bromo-3,5-dimethylphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 107725866
N-[[6-(4-chloro-3,5-dimethylphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 62322068
N-[[6-(2-methoxy-4-methylphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 62297563
N-[[6-(3-ethoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 62336369
N-[[6-(3-methoxyphenoxy)-2-pyridinyl]methyl]cyclopropanamine
CID 62298332
N-[[6-(2-methylsulfanylphenoxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 63647201
N-[[6-(4-methylcyclohexyl)oxypyridazin-3-yl]methyl]cyclopropanamine
CID 62290303
N-[[1-(4-methoxyphenyl)triazol-4-yl]methyl]cyclopropanamine
CID 66204621
N-[[6-(1,1,1-trifluoropropan-2-yloxy)pyridazin-3-yl]methyl]cyclopropanamine
CID 66276175
N-[[6-(4-methoxypyrazol-1-yl)pyridazin-3-yl]methyl]cyclopropanamine
CID 114274107
N-[[6-(4-ethylphenoxy)pyrazin-2-yl]methyl]cyclopropanamine
CID 66451008

Frequently Asked Questions

What is the IUPAC name of N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine (CID 62323240) is N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine is COc1ccc(Oc2ccc(CNC3CC3)nn2)cc1.
What is the InChIKey of N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine?
The InChIKey is WJENURYUCMPNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-19-13-5-7-14(8-6-13)20-15-9-4-12(17-18-15)10-16-11-2-3-11/h4-9,11,16H,2-3,10H2,1H3.
What are the key properties of N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine?
N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine has a molecular weight of 271.32 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(4-methoxyphenoxy)pyridazin-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62323240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).