2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine

C14H14ClNO2 — CID 79240758

IUPAC2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine
SMILESCCOc1ccc(OCc2cccc(Cl)n2)cc1
InChIInChI=1S/C14H14ClNO2/c1-2-17-12-6-8-13(9-7-12)18-10-11-4-3-5-14(15)16-11/h3-9H,2,10H2,1H3
InChIKeyMRSJXZWMLCXQCE-UHFFFAOYSA-N
MW263.72 g/mol
LogP3.71
Rot. Bonds5

About 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine

2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine (PubChem CID 79240758) has the molecular formula C14H14ClNO2 and a molecular weight of 263.72 g/mol. Its IUPAC name is 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine.

Molecular Properties

Compound Name2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine
PubChem CID79240758
Molecular FormulaC14H14ClNO2
Molecular Weight263.72 g/mol
Exact Mass263.07
IUPAC Name2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine
SMILESCCOc1ccc(OCc2cccc(Cl)n2)cc1
InChIInChI=1S/C14H14ClNO2/c1-2-17-12-6-8-13(9-7-12)18-10-11-4-3-5-14(15)16-11/h3-9H,2,10H2,1H3
InChIKeyMRSJXZWMLCXQCE-UHFFFAOYSA-N
XLogP3.71
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.72
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(4-bromophenoxy)methyl]-6-chloropyridine
CID 79240676
2-chloro-6-[(3-ethylphenoxy)methyl]pyridine
CID 79240680
2-chloro-6-[(3-chloro-4-fluorophenoxy)methyl]pyridine
CID 79040362
2-chloro-6-(methoxymethyl)pyridine
CID 78967102
2-chloro-6-[[4-(4-nitrophenoxy)phenoxy]methyl]pyridine
CID 154663357
3,6-dichloro-2-[(4-ethoxyphenoxy)methyl]pyridine
CID 62892935
2-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridine
CID 79241095
N-(6-chloro-2-pyridinyl)-4-ethoxybenzenesulfonamide
CID 104821273
2-chloro-6-(1-ethoxypropan-2-yloxymethyl)pyridine
CID 103487963
2-chloro-6-[(5-chloro-2-methylphenoxy)methyl]pyridine
CID 79243153
[6-[(4-propan-2-ylphenoxy)methyl]-2-pyridinyl]methanamine
CID 106907946
3-[(6-chloro-2-pyridinyl)methoxy]-4-methylbenzonitrile
CID 103760415

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine?
The IUPAC name of 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine (CID 79240758) is 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine.
What is the SMILES notation for 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine?
The canonical SMILES for 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine is CCOc1ccc(OCc2cccc(Cl)n2)cc1.
What is the InChIKey of 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine?
The InChIKey is MRSJXZWMLCXQCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO2/c1-2-17-12-6-8-13(9-7-12)18-10-11-4-3-5-14(15)16-11/h3-9H,2,10H2,1H3.
What are the key properties of 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine?
2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine has a molecular weight of 263.72 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[(4-ethoxyphenoxy)methyl]pyridine is sourced from PubChem (CID 79240758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).