6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine

C12H22N4O2 — CID 62284666

IUPAC6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine
SMILESCOCCCN(CCOC)c1ccc(CN)nn1
InChIInChI=1S/C12H22N4O2/c1-17-8-3-6-16(7-9-18-2)12-5-4-11(10-13)14-15-12/h4-5H,3,6-10,13H2,1-2H3
InChIKeyLIZCJCRTMKYYSH-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.42
Rot. Bonds9

About 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine

6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine (PubChem CID 62284666) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine
PubChem CID62284666
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC Name6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine
SMILESCOCCCN(CCOC)c1ccc(CN)nn1
InChIInChI=1S/C12H22N4O2/c1-17-8-3-6-16(7-9-18-2)12-5-4-11(10-13)14-15-12/h4-5H,3,6-10,13H2,1-2H3
InChIKeyLIZCJCRTMKYYSH-UHFFFAOYSA-N
XLogP0.42
TPSA73.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(aminomethyl)-N-(2-methoxyethyl)-N-prop-2-enylpyridazin-3-amine
CID 103340205
6-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine
CID 54989774
5-(2-aminoethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine
CID 80634663
5-chloro-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-2-amine
CID 66233200
4-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyrimidin-2-amine
CID 107541800
2-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridin-4-amine
CID 62284664
6-(aminomethyl)-N,N-bis(2-methoxyethyl)pyridin-2-amine
CID 62286223
2-[2-methoxyethyl(3-methoxypropyl)amino]pyridine-4-carbothioamide
CID 54990055
6-[2-methoxyethyl(3-methoxypropyl)amino]pyridine-3-carboxylic acid
CID 55137664
2-[2-methoxyethyl(3-methoxypropyl)amino]pyridine-4-carboximidamide
CID 54985064
[2-[2-methoxyethyl(3-methoxypropyl)amino]-4-pyridinyl]methanol
CID 54989948
N'-(2-methoxyethyl)-N'-pyrazin-2-ylpropane-1,3-diamine
CID 63287295

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine?
The IUPAC name of 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine (CID 62284666) is 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine.
What is the SMILES notation for 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine?
The canonical SMILES for 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine is COCCCN(CCOC)c1ccc(CN)nn1.
What is the InChIKey of 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine?
The InChIKey is LIZCJCRTMKYYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c1-17-8-3-6-16(7-9-18-2)12-5-4-11(10-13)14-15-12/h4-5H,3,6-10,13H2,1-2H3.
What are the key properties of 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine?
6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine has a molecular weight of 254.33 g/mol, XLogP of 0.42, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyridazin-3-amine is sourced from PubChem (CID 62284666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).