5-(4-chloro-2-methylphenoxy)pyrazin-2-amine

C11H10ClN3O — CID 80663336

IUPAC5-(4-chloro-2-methylphenoxy)pyrazin-2-amine
SMILESCc1cc(Cl)ccc1Oc1cnc(N)cn1
InChIInChI=1S/C11H10ClN3O/c1-7-4-8(12)2-3-9(7)16-11-6-14-10(13)5-15-11/h2-6H,1H3,(H2,13,14)
InChIKeyWKFLCSYAUINHCY-UHFFFAOYSA-N
MW235.67 g/mol
LogP2.81
Rot. Bonds2

About 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine

5-(4-chloro-2-methylphenoxy)pyrazin-2-amine (PubChem CID 80663336) has the molecular formula C11H10ClN3O and a molecular weight of 235.67 g/mol. Its IUPAC name is 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine.

Molecular Properties

Compound Name5-(4-chloro-2-methylphenoxy)pyrazin-2-amine
PubChem CID80663336
Molecular FormulaC11H10ClN3O
Molecular Weight235.67 g/mol
Exact Mass235.05
IUPAC Name5-(4-chloro-2-methylphenoxy)pyrazin-2-amine
SMILESCc1cc(Cl)ccc1Oc1cnc(N)cn1
InChIInChI=1S/C11H10ClN3O/c1-7-4-8(12)2-3-9(7)16-11-6-14-10(13)5-15-11/h2-6H,1H3,(H2,13,14)
InChIKeyWKFLCSYAUINHCY-UHFFFAOYSA-N
XLogP2.81
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.67
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-chloro-2-methylphenoxy)-4-methylpyridin-3-amine
CID 18419480
5-(2-methylphenoxy)pyrazin-2-amine
CID 80664284
6-(4-chloro-2-methylphenoxy)-2-propan-2-ylpyrimidin-4-amine
CID 80966235
1-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]propan-2-amine
CID 80639510
5-amino-2-(4-chloro-2-methylphenoxy)pyridine-4-carboxamide
CID 114090632
5-(2-tert-butyl-4-methylphenoxy)pyrazin-2-amine
CID 80664283
2-(4-chloro-2-methylphenoxy)-5-nitropyridine
CID 2800136
N-[[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62323244
5-(2-bromo-4-methoxyphenoxy)pyrazin-2-amine
CID 104708756
4-(4-chloro-2-methylphenoxy)quinolin-8-amine
CID 83060835
3-bromo-5-chloro-2-(4-chloro-2-methylphenoxy)pyridine
CID 114837551
5-[(5-chloro-2-methylphenoxy)methyl]pyrazin-2-amine
CID 103059224

Frequently Asked Questions

What is the IUPAC name of 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine?
The IUPAC name of 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine (CID 80663336) is 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine.
What is the SMILES notation for 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine?
The canonical SMILES for 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine is Cc1cc(Cl)ccc1Oc1cnc(N)cn1.
What is the InChIKey of 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine?
The InChIKey is WKFLCSYAUINHCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3O/c1-7-4-8(12)2-3-9(7)16-11-6-14-10(13)5-15-11/h2-6H,1H3,(H2,13,14).
What are the key properties of 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine?
5-(4-chloro-2-methylphenoxy)pyrazin-2-amine has a molecular weight of 235.67 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chloro-2-methylphenoxy)pyrazin-2-amine is sourced from PubChem (CID 80663336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).