6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine

C19H19N3O — CID 133468807

IUPAC6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine
SMILESCc1cncc(NCCOc2ccccc2-c2ccccc2)n1
InChIInChI=1S/C19H19N3O/c1-15-13-20-14-19(22-15)21-11-12-23-18-10-6-5-9-17(18)16-7-3-2-4-8-16/h2-10,13-14H,11-12H2,1H3,(H,21,22)
InChIKeyMAZWURLOYXPBKN-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.94
Rot. Bonds6

About 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine

6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine (PubChem CID 133468807) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine
PubChem CID133468807
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine
SMILESCc1cncc(NCCOc2ccccc2-c2ccccc2)n1
InChIInChI=1S/C19H19N3O/c1-15-13-20-14-19(22-15)21-11-12-23-18-10-6-5-9-17(18)16-7-3-2-4-8-16/h2-10,13-14H,11-12H2,1H3,(H,21,22)
InChIKeyMAZWURLOYXPBKN-UHFFFAOYSA-N
XLogP3.94
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine?
The IUPAC name of 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine (CID 133468807) is 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine.
What is the SMILES notation for 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine?
The canonical SMILES for 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine is Cc1cncc(NCCOc2ccccc2-c2ccccc2)n1.
What is the InChIKey of 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine?
The InChIKey is MAZWURLOYXPBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-15-13-20-14-19(22-15)21-11-12-23-18-10-6-5-9-17(18)16-7-3-2-4-8-16/h2-10,13-14H,11-12H2,1H3,(H,21,22).
What are the key properties of 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine?
6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine has a molecular weight of 305.38 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[2-(2-phenylphenoxy)ethyl]pyrazin-2-amine is sourced from PubChem (CID 133468807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).