2-butoxy-4-methoxypyridine

C10H15NO2 — CID 151566668

IUPAC2-butoxy-4-methoxypyridine
SMILESCCCCOc1cc(OC)ccn1
InChIInChI=1S/C10H15NO2/c1-3-4-7-13-10-8-9(12-2)5-6-11-10/h5-6,8H,3-4,7H2,1-2H3
InChIKeyQDOPXAXSAGNGGC-UHFFFAOYSA-N
MW181.24 g/mol
LogP2.27
Rot. Bonds5

About 2-butoxy-4-methoxypyridine

2-butoxy-4-methoxypyridine (PubChem CID 151566668) has the molecular formula C10H15NO2 and a molecular weight of 181.24 g/mol. Its IUPAC name is 2-butoxy-4-methoxypyridine.

Molecular Properties

Compound Name2-butoxy-4-methoxypyridine
PubChem CID151566668
Molecular FormulaC10H15NO2
Molecular Weight181.24 g/mol
Exact Mass181.11
IUPAC Name2-butoxy-4-methoxypyridine
SMILESCCCCOc1cc(OC)ccn1
InChIInChI=1S/C10H15NO2/c1-3-4-7-13-10-8-9(12-2)5-6-11-10/h5-6,8H,3-4,7H2,1-2H3
InChIKeyQDOPXAXSAGNGGC-UHFFFAOYSA-N
XLogP2.27
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-methoxy-2-propylpyridine
CID 11084054
2,4-dimethoxypyridine;toluene
CID 174791067
2-methoxy-4-[(4-methoxyphenyl)methoxy]pyridine
CID 70697685
2-(2-butoxy-4-pyridinyl)-2-oxoacetaldehyde
CID 174434804
5-butylnonan-5-yl-(4-methoxy-2-pyridinyl)tin
CID 141269215
1-methoxy-4-tetradecoxybenzene
CID 91712423
4-iodo-2-propoxypyridine
CID 66614410
(4-butoxy-2-pyridinyl)methanol
CID 61256357
4-methoxy-2-(piperidin-4-ylmethoxy)pyridine;dihydrochloride
CID 162422911
6-butoxy-N-[1-(4-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 82453620
1-(butoxymethoxy)-3-methoxybenzene
CID 142960722
2-nonoxypyridine-4-carboxamide
CID 24860246

Frequently Asked Questions

What is the IUPAC name of 2-butoxy-4-methoxypyridine?
The IUPAC name of 2-butoxy-4-methoxypyridine (CID 151566668) is 2-butoxy-4-methoxypyridine.
What is the SMILES notation for 2-butoxy-4-methoxypyridine?
The canonical SMILES for 2-butoxy-4-methoxypyridine is CCCCOc1cc(OC)ccn1.
What is the InChIKey of 2-butoxy-4-methoxypyridine?
The InChIKey is QDOPXAXSAGNGGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-3-4-7-13-10-8-9(12-2)5-6-11-10/h5-6,8H,3-4,7H2,1-2H3.
What are the key properties of 2-butoxy-4-methoxypyridine?
2-butoxy-4-methoxypyridine has a molecular weight of 181.24 g/mol, XLogP of 2.27, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butoxy-4-methoxypyridine is sourced from PubChem (CID 151566668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).