6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine

C9H14ClN3O — CID 114478234

IUPAC6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine
SMILESCCOC(C)CNc1cnnc(Cl)c1
InChIInChI=1S/C9H14ClN3O/c1-3-14-7(2)5-11-8-4-9(10)13-12-6-8/h4,6-7H,3,5H2,1-2H3,(H,11,13)
InChIKeyBCMJHFGZKXYOQG-UHFFFAOYSA-N
MW215.68 g/mol
LogP1.97
Rot. Bonds5

About 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine

6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine (PubChem CID 114478234) has the molecular formula C9H14ClN3O and a molecular weight of 215.68 g/mol. Its IUPAC name is 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine.

Molecular Properties

Compound Name6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine
PubChem CID114478234
Molecular FormulaC9H14ClN3O
Molecular Weight215.68 g/mol
Exact Mass215.08
IUPAC Name6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine
SMILESCCOC(C)CNc1cnnc(Cl)c1
InChIInChI=1S/C9H14ClN3O/c1-3-14-7(2)5-11-8-4-9(10)13-12-6-8/h4,6-7H,3,5H2,1-2H3,(H,11,13)
InChIKeyBCMJHFGZKXYOQG-UHFFFAOYSA-N
XLogP1.97
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.68
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-ethylpyridazin-4-amine
CID 88853962
6-chloro-4-N-(2-ethoxypropyl)pyrimidine-2,4-diamine
CID 115658236
N-(2-butoxyethyl)-6-chloropyridazin-4-amine
CID 114478451
6-chloro-N-(4-methylhexan-2-yl)pyridazin-4-amine
CID 114478151
5-[(2S)-butan-2-yl]oxy-3-chloropyridazine
CID 86335315
N-(2-ethoxypropyl)-5-methylpyrimidin-2-amine
CID 115774164
6-chloro-N-(2-methyl-2-methylsulfonylpropyl)pyridazin-4-amine
CID 114478179
5-amino-3-chloro-2-(2-ethoxypropylamino)benzamide
CID 107196713
6-bromo-2-N-(2-ethoxypropyl)pyrimidine-2,4-diamine
CID 116797393
6-chloro-N-(2-pyrazol-1-ylethyl)pyridazin-4-amine
CID 114478512
1-[4-(2-ethoxypropylamino)phenyl]ethanone
CID 114468455
4-N-(2-ethoxypropyl)-6-(trifluoromethyl)pyridine-3,4-diamine
CID 106748056

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine?
The IUPAC name of 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine (CID 114478234) is 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine.
What is the SMILES notation for 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine?
The canonical SMILES for 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine is CCOC(C)CNc1cnnc(Cl)c1.
What is the InChIKey of 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine?
The InChIKey is BCMJHFGZKXYOQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClN3O/c1-3-14-7(2)5-11-8-4-9(10)13-12-6-8/h4,6-7H,3,5H2,1-2H3,(H,11,13).
What are the key properties of 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine?
6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine has a molecular weight of 215.68 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-ethoxypropyl)pyridazin-4-amine is sourced from PubChem (CID 114478234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).