N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine

C15H19N3O — CID 80881852

IUPACN-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine
SMILESCCNc1cncc(Oc2cc(C)cc(C)c2C)n1
InChIInChI=1S/C15H19N3O/c1-5-17-14-8-16-9-15(18-14)19-13-7-10(2)6-11(3)12(13)4/h6-9H,5H2,1-4H3,(H,17,18)
InChIKeyBPIKFNMQRJNWOF-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.63
Rot. Bonds4

About N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine

N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine (PubChem CID 80881852) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine.

Molecular Properties

Compound NameN-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine
PubChem CID80881852
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine
SMILESCCNc1cncc(Oc2cc(C)cc(C)c2C)n1
InChIInChI=1S/C15H19N3O/c1-5-17-14-8-16-9-15(18-14)19-13-7-10(2)6-11(3)12(13)4/h6-9H,5H2,1-4H3,(H,17,18)
InChIKeyBPIKFNMQRJNWOF-UHFFFAOYSA-N
XLogP3.63
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-(2,4,5-trichlorophenoxy)pyrazin-2-amine
CID 80863080
N-ethyl-4-methyl-6-(2,3,5-trimethylphenoxy)pyrimidin-2-amine
CID 80881926
N-[[6-(2,3,5-trimethylphenoxy)pyrazin-2-yl]methyl]propan-2-amine
CID 66451416
6-(4-chloro-2-methyl-5-propan-2-ylphenoxy)-N-ethylpyrazin-2-amine
CID 80875965
N-[[6-(2,3,5-trimethylphenoxy)pyrazin-2-yl]methyl]cyclopropanamine
CID 66451411
N-ethyl-5-methyl-4-(2,3,5-trimethylphenoxy)pyrimidin-2-amine
CID 80881682
N-ethyl-6-methoxypyrazin-2-amine
CID 21419063
N-ethyl-6-(3-methyl-4-nitrophenoxy)pyrazin-2-amine
CID 80870463
2-methyl-N-propyl-6-(2,3,5-trimethylphenoxy)pyrimidin-4-amine
CID 80874964
N-ethyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
CID 62194827
4-chloro-N-ethyl-6-(2,3,5-trimethylphenoxy)-1,3,5-triazin-2-amine
CID 80882080
N-ethyl-6-(4-methoxy-2-nitrophenoxy)pyrazin-2-amine
CID 78989587

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine?
The IUPAC name of N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine (CID 80881852) is N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine.
What is the SMILES notation for N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine?
The canonical SMILES for N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine is CCNc1cncc(Oc2cc(C)cc(C)c2C)n1.
What is the InChIKey of N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine?
The InChIKey is BPIKFNMQRJNWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-5-17-14-8-16-9-15(18-14)19-13-7-10(2)6-11(3)12(13)4/h6-9H,5H2,1-4H3,(H,17,18).
What are the key properties of N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine?
N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(2,3,5-trimethylphenoxy)pyrazin-2-amine is sourced from PubChem (CID 80881852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).