N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine

C14H17N3O2 — CID 80865438

IUPACN-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine
SMILESCCNc1cncc(OCc2ccc(OC)cc2)n1
InChIInChI=1S/C14H17N3O2/c1-3-16-13-8-15-9-14(17-13)19-10-11-4-6-12(18-2)7-5-11/h4-9H,3,10H2,1-2H3,(H,16,17)
InChIKeyZWBAVFAUGVYZFM-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.50
Rot. Bonds6

About N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine

N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine (PubChem CID 80865438) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine.

Molecular Properties

Compound NameN-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine
PubChem CID80865438
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine
SMILESCCNc1cncc(OCc2ccc(OC)cc2)n1
InChIInChI=1S/C14H17N3O2/c1-3-16-13-8-15-9-14(17-13)19-10-11-4-6-12(18-2)7-5-11/h4-9H,3,10H2,1-2H3,(H,16,17)
InChIKeyZWBAVFAUGVYZFM-UHFFFAOYSA-N
XLogP2.50
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine?
The IUPAC name of N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine (CID 80865438) is N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine.
What is the SMILES notation for N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine?
The canonical SMILES for N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine is CCNc1cncc(OCc2ccc(OC)cc2)n1.
What is the InChIKey of N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine?
The InChIKey is ZWBAVFAUGVYZFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-16-13-8-15-9-14(17-13)19-10-11-4-6-12(18-2)7-5-11/h4-9H,3,10H2,1-2H3,(H,16,17).
What are the key properties of N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine?
N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine has a molecular weight of 259.31 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[(4-methoxyphenyl)methoxy]pyrazin-2-amine is sourced from PubChem (CID 80865438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).