2-chloro-6-(2-propan-2-ylphenoxy)pyrazine

C13H13ClN2O — CID 54915358

IUPAC2-chloro-6-(2-propan-2-ylphenoxy)pyrazine
SMILESCC(C)c1ccccc1Oc1cncc(Cl)n1
InChIInChI=1S/C13H13ClN2O/c1-9(2)10-5-3-4-6-11(10)17-13-8-15-7-12(14)16-13/h3-9H,1-2H3
InChIKeyLNLVWXCJALPGRG-UHFFFAOYSA-N
MW248.71 g/mol
LogP4.05
Rot. Bonds3

About 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine

2-chloro-6-(2-propan-2-ylphenoxy)pyrazine (PubChem CID 54915358) has the molecular formula C13H13ClN2O and a molecular weight of 248.71 g/mol. Its IUPAC name is 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine.

Molecular Properties

Compound Name2-chloro-6-(2-propan-2-ylphenoxy)pyrazine
PubChem CID54915358
Molecular FormulaC13H13ClN2O
Molecular Weight248.71 g/mol
Exact Mass248.07
IUPAC Name2-chloro-6-(2-propan-2-ylphenoxy)pyrazine
SMILESCC(C)c1ccccc1Oc1cncc(Cl)n1
InChIInChI=1S/C13H13ClN2O/c1-9(2)10-5-3-4-6-11(10)17-13-8-15-7-12(14)16-13/h3-9H,1-2H3
InChIKeyLNLVWXCJALPGRG-UHFFFAOYSA-N
XLogP4.05
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.71
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-6-(2-methoxyphenoxy)pyrazine
CID 61057285
3-chloro-6-(2-propan-2-ylphenoxy)pyridazine
CID 54915404
5-chloro-2-(2-propan-2-ylphenoxy)pyridine
CID 66234112
2-(6-chloropyrazin-2-yl)oxybenzoic acid
CID 114335564
2-(chloromethyl)-6-(2-propan-2-ylphenoxy)pyridine
CID 62240218
6-(2-propan-2-ylphenoxy)pyridin-3-amine
CID 16641865
3,5-dichloro-N-methyl-6-(2-propan-2-ylphenoxy)pyridin-2-amine
CID 102760710
5-(2-propan-2-ylphenoxy)pyridine-3-carbaldehyde
CID 113469446
methyl 2-[2-(6-chloropyrazin-2-yl)oxyphenyl]-3-methoxyprop-2-enoate
CID 54220011
6-(4-bromo-2-propan-2-ylphenoxy)pyrazin-2-amine
CID 113303072
2-chloro-6-(4-methylphenoxy)pyrazine
CID 60726835
2-chloro-6-(3-ethoxyphenoxy)pyrazine
CID 55061194

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine?
The IUPAC name of 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine (CID 54915358) is 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine.
What is the SMILES notation for 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine?
The canonical SMILES for 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine is CC(C)c1ccccc1Oc1cncc(Cl)n1.
What is the InChIKey of 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine?
The InChIKey is LNLVWXCJALPGRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2O/c1-9(2)10-5-3-4-6-11(10)17-13-8-15-7-12(14)16-13/h3-9H,1-2H3.
What are the key properties of 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine?
2-chloro-6-(2-propan-2-ylphenoxy)pyrazine has a molecular weight of 248.71 g/mol, XLogP of 4.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(2-propan-2-ylphenoxy)pyrazine is sourced from PubChem (CID 54915358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).