N-ethoxy-N,5,6-trimethylpyridazin-3-amine

C9H15N3O — CID 130653918

IUPACN-ethoxy-N,5,6-trimethylpyridazin-3-amine
SMILESCCON(C)c1cc(C)c(C)nn1
InChIInChI=1S/C9H15N3O/c1-5-13-12(4)9-6-7(2)8(3)10-11-9/h6H,5H2,1-4H3
InChIKeyYTSZKOCJONQORA-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.48
Rot. Bonds3

About N-ethoxy-N,5,6-trimethylpyridazin-3-amine

N-ethoxy-N,5,6-trimethylpyridazin-3-amine (PubChem CID 130653918) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is N-ethoxy-N,5,6-trimethylpyridazin-3-amine.

Molecular Properties

Compound NameN-ethoxy-N,5,6-trimethylpyridazin-3-amine
PubChem CID130653918
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC NameN-ethoxy-N,5,6-trimethylpyridazin-3-amine
SMILESCCON(C)c1cc(C)c(C)nn1
InChIInChI=1S/C9H15N3O/c1-5-13-12(4)9-6-7(2)8(3)10-11-9/h6H,5H2,1-4H3
InChIKeyYTSZKOCJONQORA-UHFFFAOYSA-N
XLogP1.48
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-N-ethoxy-2-N,4-dimethylpyridine-2,5-diamine
CID 131097140
N,5,6-trimethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridazin-3-amine
CID 133489512
propane;3,4,6-trimethylpyridazine
CID 143900357
N-[(4-chlorophenyl)methyl]-N,5,6-trimethylpyridazin-3-amine
CID 133488301
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-ethyl-5,6-dimethylpyridazin-3-amine
CID 133489254
N-ethoxy-5-fluoro-N-methylpyrimidin-2-amine
CID 130637561
5-bromo-N-ethoxy-N-methylpyrimidin-4-amine
CID 131159567
3,4-dimethyl-6-phenylpyridazine
CID 14040320
N,N-diethoxy-2-methylaniline
CID 57156953
5-bromo-N-(4-ethoxyphenyl)-N,4-dimethylpyridin-2-amine
CID 115147054
6-[(2-ethyltetrazol-5-yl)methoxy]-3,4-dimethylpyridazine
CID 167823968
N,5,6-trimethyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyridazin-3-amine
CID 133488618

Frequently Asked Questions

What is the IUPAC name of N-ethoxy-N,5,6-trimethylpyridazin-3-amine?
The IUPAC name of N-ethoxy-N,5,6-trimethylpyridazin-3-amine (CID 130653918) is N-ethoxy-N,5,6-trimethylpyridazin-3-amine.
What is the SMILES notation for N-ethoxy-N,5,6-trimethylpyridazin-3-amine?
The canonical SMILES for N-ethoxy-N,5,6-trimethylpyridazin-3-amine is CCON(C)c1cc(C)c(C)nn1.
What is the InChIKey of N-ethoxy-N,5,6-trimethylpyridazin-3-amine?
The InChIKey is YTSZKOCJONQORA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-5-13-12(4)9-6-7(2)8(3)10-11-9/h6H,5H2,1-4H3.
What are the key properties of N-ethoxy-N,5,6-trimethylpyridazin-3-amine?
N-ethoxy-N,5,6-trimethylpyridazin-3-amine has a molecular weight of 181.24 g/mol, XLogP of 1.48, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-N,5,6-trimethylpyridazin-3-amine is sourced from PubChem (CID 130653918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).