2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine

C11H15Cl2NO2 — CID 106994443

IUPAC2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine
SMILESCC(C)OCCOCc1ccc(Cl)nc1Cl
InChIInChI=1S/C11H15Cl2NO2/c1-8(2)16-6-5-15-7-9-3-4-10(12)14-11(9)13/h3-4,8H,5-7H2,1-2H3
InChIKeyQLVBSYVZXUWSBI-UHFFFAOYSA-N
MW264.15 g/mol
LogP3.33
Rot. Bonds6

About 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine

2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine (PubChem CID 106994443) has the molecular formula C11H15Cl2NO2 and a molecular weight of 264.15 g/mol. Its IUPAC name is 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine.

Molecular Properties

Compound Name2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine
PubChem CID106994443
Molecular FormulaC11H15Cl2NO2
Molecular Weight264.15 g/mol
Exact Mass263.05
IUPAC Name2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine
SMILESCC(C)OCCOCc1ccc(Cl)nc1Cl
InChIInChI=1S/C11H15Cl2NO2/c1-8(2)16-6-5-15-7-9-3-4-10(12)14-11(9)13/h3-4,8H,5-7H2,1-2H3
InChIKeyQLVBSYVZXUWSBI-UHFFFAOYSA-N
XLogP3.33
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.15
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,6-dichloro-3-[2-(2-methoxyethoxy)ethoxymethyl]pyridine
CID 106994651
2,6-dichloro-3-[2-(3-methoxypropoxy)ethoxymethyl]pyridine
CID 106994670
2,6-dichloro-3-(1-methoxypropan-2-yloxymethyl)pyridine
CID 106994598
2,6-dichloro-3-(octoxymethyl)pyridine
CID 106994491
2,6-dichloro-3-(1-ethoxypropan-2-yloxymethyl)pyridine
CID 106994675
N-[(2,6-dichloro-3-pyridinyl)methyl]-N-(2-methoxyethyl)pentan-3-amine
CID 106993658
2,6-dichloro-3-propylpyridine
CID 23131294
N-[(2,6-dichloro-3-pyridinyl)methyl]-N-ethylpropan-2-amine
CID 106993484
2-[2-[2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 87184275
1-(2,6-dichloro-3-pyridinyl)-N-methylmethanamine
CID 22450421
5-fluoro-2-(2-propan-2-yloxyethoxymethyl)benzoic acid
CID 63292747
N-ethyl-3-(2-propan-2-yloxyethoxymethyl)quinolin-2-amine
CID 62193399

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine?
The IUPAC name of 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine (CID 106994443) is 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine.
What is the SMILES notation for 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine?
The canonical SMILES for 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine is CC(C)OCCOCc1ccc(Cl)nc1Cl.
What is the InChIKey of 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine?
The InChIKey is QLVBSYVZXUWSBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Cl2NO2/c1-8(2)16-6-5-15-7-9-3-4-10(12)14-11(9)13/h3-4,8H,5-7H2,1-2H3.
What are the key properties of 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine?
2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine has a molecular weight of 264.15 g/mol, XLogP of 3.33, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-3-(2-propan-2-yloxyethoxymethyl)pyridine is sourced from PubChem (CID 106994443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).