ethane;5-methoxy-3-propan-2-ylpyridazine

C10H18N2O — CID 166553087

IUPACethane;5-methoxy-3-propan-2-ylpyridazine
SMILESCC.COc1cnnc(C(C)C)c1
InChIInChI=1S/C8H12N2O.C2H6/c1-6(2)8-4-7(11-3)5-9-10-8;1-2/h4-6H,1-3H3;1-2H3
InChIKeyNZCSETNWKDQVCA-UHFFFAOYSA-N
MW182.27 g/mol
LogP2.63
Rot. Bonds2

About ethane;5-methoxy-3-propan-2-ylpyridazine

ethane;5-methoxy-3-propan-2-ylpyridazine (PubChem CID 166553087) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is ethane;5-methoxy-3-propan-2-ylpyridazine.

Molecular Properties

Compound Nameethane;5-methoxy-3-propan-2-ylpyridazine
PubChem CID166553087
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Nameethane;5-methoxy-3-propan-2-ylpyridazine
SMILESCC.COc1cnnc(C(C)C)c1
InChIInChI=1S/C8H12N2O.C2H6/c1-6(2)8-4-7(11-3)5-9-10-8;1-2/h4-6H,1-3H3;1-2H3
InChIKeyNZCSETNWKDQVCA-UHFFFAOYSA-N
XLogP2.63
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-3-propan-2-ylpyridazine
CID 122547241
ethane;5-methyl-3-propan-2-ylpyridazine
CID 144528094
3,5-di(propan-2-yl)pyridazine
CID 21037378
3-bromo-5-methoxypyridazine
CID 118497529
5-chloro-3-propan-2-ylpyridazine
CID 117106924
5-(3,3-dimethylbutyl)-3-propan-2-ylpyridazine;ethane
CID 142361365
ethane;6-propan-2-yl-1,2,4-triazine
CID 142334326
7-methoxy-4-propan-2-ylcinnoline
CID 164758055
N-(6-propan-2-ylpyridazin-4-yl)acetamide
CID 153291131
3-[3-(difluoromethyl)-1-methylpyrazol-5-yl]oxy-5-methoxypyridazine
CID 19436780
4-tert-butyl-3-methoxy-6-propan-2-ylpyridazine
CID 126747874
3-bromo-5-methoxy-N-methylpyridin-2-amine
CID 175331682

Frequently Asked Questions

What is the IUPAC name of ethane;5-methoxy-3-propan-2-ylpyridazine?
The IUPAC name of ethane;5-methoxy-3-propan-2-ylpyridazine (CID 166553087) is ethane;5-methoxy-3-propan-2-ylpyridazine.
What is the SMILES notation for ethane;5-methoxy-3-propan-2-ylpyridazine?
The canonical SMILES for ethane;5-methoxy-3-propan-2-ylpyridazine is CC.COc1cnnc(C(C)C)c1.
What is the InChIKey of ethane;5-methoxy-3-propan-2-ylpyridazine?
The InChIKey is NZCSETNWKDQVCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O.C2H6/c1-6(2)8-4-7(11-3)5-9-10-8;1-2/h4-6H,1-3H3;1-2H3.
What are the key properties of ethane;5-methoxy-3-propan-2-ylpyridazine?
ethane;5-methoxy-3-propan-2-ylpyridazine has a molecular weight of 182.27 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methoxy-3-propan-2-ylpyridazine is sourced from PubChem (CID 166553087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).