2-chloro-5-(3-propan-2-ylphenoxy)pyridine

C14H14ClNO — CID 82225199

IUPAC2-chloro-5-(3-propan-2-ylphenoxy)pyridine
SMILESCC(C)c1cccc(Oc2ccc(Cl)nc2)c1
InChIInChI=1S/C14H14ClNO/c1-10(2)11-4-3-5-12(8-11)17-13-6-7-14(15)16-9-13/h3-10H,1-2H3
InChIKeyUEBDESCJPPLTTK-UHFFFAOYSA-N
MW247.73 g/mol
LogP4.65
Rot. Bonds3

About 2-chloro-5-(3-propan-2-ylphenoxy)pyridine

2-chloro-5-(3-propan-2-ylphenoxy)pyridine (PubChem CID 82225199) has the molecular formula C14H14ClNO and a molecular weight of 247.73 g/mol. Its IUPAC name is 2-chloro-5-(3-propan-2-ylphenoxy)pyridine.

Molecular Properties

Compound Name2-chloro-5-(3-propan-2-ylphenoxy)pyridine
PubChem CID82225199
Molecular FormulaC14H14ClNO
Molecular Weight247.73 g/mol
Exact Mass247.08
IUPAC Name2-chloro-5-(3-propan-2-ylphenoxy)pyridine
SMILESCC(C)c1cccc(Oc2ccc(Cl)nc2)c1
InChIInChI=1S/C14H14ClNO/c1-10(2)11-4-3-5-12(8-11)17-13-6-7-14(15)16-9-13/h3-10H,1-2H3
InChIKeyUEBDESCJPPLTTK-UHFFFAOYSA-N
XLogP4.65
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.73
LogP ≤ 54.65
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

(1R)-1-[5-(3-propan-2-ylphenoxy)-2-pyridinyl]ethanamine
CID 83127124
1,3-bis(3-propan-2-ylphenoxy)benzene
CID 90260311
3-[(6-chloro-3-pyridinyl)oxy]benzaldehyde
CID 170946631
3-(chloromethyl)-5-(3-propan-2-ylphenoxy)pyridine
CID 113469499
CID 91869714
CID 91869714
2-chloro-5-(3,4-dimethylphenoxy)pyridine
CID 82225184
1-methyl-3-(3-propan-2-ylphenoxy)benzene
CID 70851605
(1R)-1-[4-(3-propan-2-ylphenoxy)phenyl]ethanamine
CID 29276487
1-[4-(3-propan-2-ylphenoxy)phenyl]ethanamine
CID 43102412
1-[3-[(6-methyl-3-pyridinyl)oxy]phenyl]ethanamine;hydrochloride
CID 175550397
5-(chloromethyl)-2-(3-propan-2-ylphenoxy)pyrimidine
CID 113387977
1-[3-[(6-chloro-3-pyridinyl)oxy]phenyl]-4-methylpiperazine
CID 59588917

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(3-propan-2-ylphenoxy)pyridine?
The IUPAC name of 2-chloro-5-(3-propan-2-ylphenoxy)pyridine (CID 82225199) is 2-chloro-5-(3-propan-2-ylphenoxy)pyridine.
What is the SMILES notation for 2-chloro-5-(3-propan-2-ylphenoxy)pyridine?
The canonical SMILES for 2-chloro-5-(3-propan-2-ylphenoxy)pyridine is CC(C)c1cccc(Oc2ccc(Cl)nc2)c1.
What is the InChIKey of 2-chloro-5-(3-propan-2-ylphenoxy)pyridine?
The InChIKey is UEBDESCJPPLTTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO/c1-10(2)11-4-3-5-12(8-11)17-13-6-7-14(15)16-9-13/h3-10H,1-2H3.
What are the key properties of 2-chloro-5-(3-propan-2-ylphenoxy)pyridine?
2-chloro-5-(3-propan-2-ylphenoxy)pyridine has a molecular weight of 247.73 g/mol, XLogP of 4.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(3-propan-2-ylphenoxy)pyridine is sourced from PubChem (CID 82225199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).