2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine

C13H11Cl2NO — CID 62472103

IUPAC2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine
SMILESClc1cc(COCc2ccccc2Cl)ccn1
InChIInChI=1S/C13H11Cl2NO/c14-12-4-2-1-3-11(12)9-17-8-10-5-6-16-13(15)7-10/h1-7H,8-9H2
InChIKeyOBZYUGHEHQGZGM-UHFFFAOYSA-N
MW268.14 g/mol
LogP4.11
Rot. Bonds4

About 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine

2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine (PubChem CID 62472103) has the molecular formula C13H11Cl2NO and a molecular weight of 268.14 g/mol. Its IUPAC name is 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine.

Molecular Properties

Compound Name2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine
PubChem CID62472103
Molecular FormulaC13H11Cl2NO
Molecular Weight268.14 g/mol
Exact Mass267.02
IUPAC Name2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine
SMILESClc1cc(COCc2ccccc2Cl)ccn1
InChIInChI=1S/C13H11Cl2NO/c14-12-4-2-1-3-11(12)9-17-8-10-5-6-16-13(15)7-10/h1-7H,8-9H2
InChIKeyOBZYUGHEHQGZGM-UHFFFAOYSA-N
XLogP4.11
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.14
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-4-(2-phenylethoxymethyl)pyridine
CID 114999592
2-chloro-4-(2-pyridin-2-ylethoxymethyl)pyridine
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2-chloro-4-(2,2,2-trifluoroethoxymethyl)pyridine
CID 62470096
2-chloro-4-(2-propoxyethoxymethyl)pyridine
CID 63684727
[4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane
CID 103438617
2-chloro-4-[(4-chloronaphthalen-1-yl)oxymethyl]pyridine
CID 63480612
2-[(2-chloro-4-pyridinyl)methoxy]aniline
CID 62469846
2-chloro-4-(3,3-dimethylbutoxymethyl)pyridine
CID 66231568
2-chloro-4-(pent-4-enoxymethyl)pyridine
CID 79114699
3-[(2-chlorophenyl)methoxymethyl]-5-fluoroaniline
CID 112646463
2-chloro-4-(4,4,4-trifluorobutoxymethyl)pyridine
CID 82788913
2-chloro-4-[(2,6-difluorophenoxy)methyl]pyridine
CID 78987592

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine?
The IUPAC name of 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine (CID 62472103) is 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine.
What is the SMILES notation for 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine?
The canonical SMILES for 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine is Clc1cc(COCc2ccccc2Cl)ccn1.
What is the InChIKey of 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine?
The InChIKey is OBZYUGHEHQGZGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2NO/c14-12-4-2-1-3-11(12)9-17-8-10-5-6-16-13(15)7-10/h1-7H,8-9H2.
What are the key properties of 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine?
2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine has a molecular weight of 268.14 g/mol, XLogP of 4.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-[(2-chlorophenyl)methoxymethyl]pyridine is sourced from PubChem (CID 62472103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).